Results for:
Species: Penicillium expansum

(4S,4aS,8aR)-4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-ol

Compound Details

Synonymous names
JLPUXFOGCDVKGO-TUAOUCFPSA-N
GEOSMIN
AC1L1I2Q
MYW912WXJ4
UNII-MYW912WXJ4
SCHEMBL50009
C16286
OR238484
4,8a-Dimethyl-decahydronaphthalen-4a-ol
OR031361
4,8alpha-dimethyl-octahydro-naphthalen-4alpha-ol
CHEMBL2374043
CHEBI:46702
ZINC3870304
(-)-geosmin
LS-95000
trans-1,10-dimethyl-trans-decalol
Octahydro-4alpha,8abeta-dimethyl-4aalpha(2H)-naphthol
AKOS006282977
trans-1,10-Dimethyl-trans-9-decalol
4,8a-Dimethyloctahydro-4a(2H)-naphthalenol #
Octahydro-4,8a-dimethyl-4a(2H)-naphthalenol
NCGC00165950-01
EINECS 243-239-8
19700-21-1
4a-alpha-(2H)-Naphthol, octahydro-4-alpha,8a-beta-dimethyl-
(4S,4aS,8aR)-4,8a-dimethyloctahydronaphthalen-4a(2H)-ol
4a-alpha-(2H)-Naphthol, octahydro-4-alpha,8a-beta-dimethyl- (8CI)
(4S-(4alpha,4aalpha,8abeta))-Octahydro-4,8a-dimethyl-4a(2H)-naphthol
4a-.alpha.-(2H)-Naphthol, octahydro-4-.alpha.,8a-.beta.-dimethyl-
4a(2H)-Naphthalenol, octahydro-4,8a-dimethyl-,(4.alpha.,4a.alpha.,8a.beta.)-
4a(2H)-Naphthalenol, octahydro-4,8a-dimethyl-, (4S-(4-alpha,4a-alpha,8a-beta))-
(4S,4aS,8aR)-4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-ol
4a(2H)-Naphthalenol, octahydro-4,8a-dimethyl-, [4S-(4.alpha.,4a.alpha.,8a.beta.)]-
IUPAC name(4S,4aS,8aR)-4,8a-dimethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-ol
SMILESCC1CCCC2(C1(CCCC2)O)C
InchiInChI=1S/C12H22O/c1-10-6-5-8-11(2)7-3-4-9-12(10,11)13/h10,13H,3-9H2,1-2H3/t10-,11+,12-/m0/s1
FormulaC12H22O
PubChem ID29746
Molweight182.307
LogP3.17
Atoms35
Bonds36
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationTerpenes Bicyclo Alcohols

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaActinomycetes Spp.n/aDickschat et al., 2007
BacteriaCyanobacterian/aDickschat et al., 2007
BacteriaMyxobacterium Spp.n/aDickschat et al., 2007
BacteriaMyxococcus Xanthusn/aNawrath et al., 2008
BacteriaNannocystis Exedens Na E485n/aDickschat et al., 2007
BacteriaNannocystis Exedens Na EB37n/aDickschat et al., 2007
BacteriaNannocystis Exedens Subsp. Cinnabarina Na C29n/aDickschat et al., 2007
BacteriaStigmatella Aurantiaca DW4/3-1n/aDickschat et al., 2005_5
BacteriaStigmatella Aurantiaca Sg A15n/aDickschat et al., 2005_5
BacteriaStreptomyces Griseusn/aNawrath et al., 2008
BacteriaStreptomyces Spp.n/aDickschat et al., 2007
BacteriaActinobacteria Sp.n/aStahl and Parkin, 1976
BacteriaAnabaena Sp.n/aSchulz and Dickschat, 2007
BacteriaBiofilms A (Rivularia Sp./Calothrix Parietina Community)n/aHoeckelmann et al., 2004
BacteriaCalothrix Parietina PCC 6303n/aHoeckelmann et al., 2004
BacteriaCalothrix Sp.n/aHoeckelmann et al., 2004
BacteriaCalothrix Spp.n/aSchulz and Dickschat, 2007
BacteriaChondromyces Crocatusn/aSchulz and Dickschat, 2007
BacteriaChondromyces Crocatus Cm C2n/aSchulz et al., 2004
BacteriaCyanobacterian/aHoeckelmann et al., 2004
BacteriaLyngbyan/aSchulz and Dickschat, 2007
BacteriaMarine Streptomycete (isolate B6007)n/aStritzke et al., 2004
BacteriaMyxobacterium Spp.n/aDickschat et al., 2004
BacteriaMyxococcus Xanthusn/aSchulz and Dickschat, 2007
BacteriaNannocystis Exedensn/aSchulz and Dickschat, 2007
BacteriaOscillatoria Sp.n/aSchulz and Dickschat, 2007
BacteriaPhormidium Sp.n/aHoeckelmann et al., 2004
BacteriaRivularia Sp.n/aHoeckelmann et al., 2004
BacteriaStigmatella Aurantiacan/aSchulz and Dickschat, 2007
BacteriaStreptomyces Albidoflavusn/aSchulz and Dickschat, 2007
BacteriaStreptomyces Albidoflavus AMI 246n/aSchoeller et al., 2002
BacteriaStreptomyces Albusn/aSchulz and Dickschat, 2007
BacteriaStreptomyces Albus IFO 13014n/aSchoeller et al., 2002
BacteriaStreptomyces Antibioticusn/aSchulz and Dickschat, 2007
BacteriaStreptomyces Antibioticus CBS 659.68n/aSchoeller et al., 2002
BacteriaStreptomyces Antibioticus IMRU 3491nanaGerber and Lechavelier, 1967
BacteriaStreptomyces Antibioticus IMRU 3720nanaGerber and Lechavelier, 1966
BacteriaStreptomyces Aureofaciens ETH 13387n/aSchoeller et al., 2002
BacteriaStreptomyces Aureofaciens ETH 28832n/aSchoeller et al., 2002
BacteriaStreptomyces Citreusn/aSchulz and Dickschat, 2007
BacteriaStreptomyces Coelicolorn/aDickschat et al., 2005
BacteriaStreptomyces Coelicolor DSM 40233n/aSchoeller et al., 2002
BacteriaStreptomyces Diastatochromogenes ETH 18822n/aSchoeller et al., 2002
BacteriaStreptomyces Fradiae IMRU 3535nanaGerber and Lechavelier, 1968
BacteriaStreptomyces Fradiae IMRU 3535-R7nanaGerber and Lechavelier, 1969
BacteriaStreptomyces Griseusn/aDickschat et al., 2005
BacteriaStreptomyces Griseus ATCC 23345n/aSchoeller et al., 2002
BacteriaStreptomyces Griseus LP-16nanaGerber and Lechavelier, 1965
BacteriaStreptomyces Griseus Subsp. Griseus DSM 40236nasoilWilkins, 1996
BacteriaStreptomyces Hirsutus ATCC 19773n/aSchoeller et al., 2002
BacteriaStreptomyces Hirsutus ETH 1666n/aSchoeller et al., 2002
BacteriaStreptomyces Hygroscopicus ATCC 27438n/aSchoeller et al., 2002
BacteriaStreptomyces Hygroscopicus IFO 13255n/aSchoeller et al., 2002
BacteriaStreptomyces Murinus DSM 40091n/aSchoeller et al., 2002
BacteriaStreptomyces Murinus NRRL 8171n/aSchoeller et al., 2002
BacteriaStreptomyces Odorifer IMRU 3334nanaGerber and Lechavelier, 1970
BacteriaStreptomyces Olivaceus ETH 7437n/aSchoeller et al., 2002
BacteriaStreptomyces Rishiriensis AMI 224n/aSchoeller et al., 2002
BacteriaStreptomyces Sp. GWS-BW-H5.n/aDickschat et al., 2005_2
BacteriaStreptomyces Spp.n/aSchulz and Dickschat, 2007
BacteriaStreptomyces Spp. AMI 240n/aSchoeller et al., 2002
BacteriaStreptomyces Spp. AMI 243n/aSchoeller et al., 2002
BacteriaStreptomyces Sulfureusn/aSchulz and Dickschat, 2007
BacteriaStreptomyces Thermoviolaceus IFO 12382n/aSchoeller et al., 2002
FungiArmillaria Mellean/aMueller et al., 2013
Fungi Aspergillus NigerPriegnitz et al. 2015
Fungi Chaetomium GlobosumKikuchi et al. 1983
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPenicillium DiscolorSchnürer et al. 1999
FungiPenicillium Expansumn/aMattheis and Roberts, 1992
FungiPenicillium Polonicumnawater damaged buildings, BelgiumPolizzi et al., 2012
Fungi Penicillium Sp.Larsen and Frisvad 1995
FungiPholiota Squarrosan/aMueller et al., 2013
Fungi Streptomyces GriseusGerber and Lechevalier 1965
FungiVerticillium Longisporumn/aMueller et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaActinomycetes Spp.n/an/a
BacteriaCyanobacterian/an/a
BacteriaMyxobacterium Spp.n/an/a
BacteriaMyxococcus Xanthusn/an/a
BacteriaNannocystis Exedens Na E485n/an/a
BacteriaNannocystis Exedens Na EB37n/an/a
BacteriaNannocystis Exedens Subsp. Cinnabarina Na C29n/an/a
BacteriaStigmatella Aurantiaca DW4/3-1n/an/a
BacteriaStigmatella Aurantiaca Sg A15n/an/a
BacteriaStreptomyces Griseusn/an/a
BacteriaStreptomyces Spp.n/an/a
BacteriaActinobacteria Sp.n/an/a
BacteriaAnabaena Sp.n/an/a
BacteriaBiofilms A (Rivularia Sp./Calothrix Parietina Community)n/an/a
BacteriaCalothrix Parietina PCC 6303n/an/a
BacteriaCalothrix Sp.n/an/a
BacteriaCalothrix Spp.n/an/a
BacteriaChondromyces Crocatusn/an/a
BacteriaChondromyces Crocatus Cm C2n/an/a
BacteriaLyngbyan/an/a
BacteriaMarine Streptomycete (isolate B6007)n/an/a
BacteriaNannocystis Exedensn/an/a
BacteriaOscillatoria Sp.n/an/a
BacteriaPhormidium Sp.n/an/a
BacteriaRivularia Sp.n/an/a
BacteriaStigmatella Aurantiacan/an/a
BacteriaStreptomyces Albidoflavusn/an/a
BacteriaStreptomyces Albidoflavus AMI 246Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Albusn/an/a
BacteriaStreptomyces Albus IFO 13014Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Antibioticusn/an/a
BacteriaStreptomyces Antibioticus CBS 659.68Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Antibioticus IMRU 3491PablumGC
BacteriaStreptomyces Antibioticus IMRU 3720SBM/Pablum GC
BacteriaStreptomyces Aureofaciens ETH 13387Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Aureofaciens ETH 28832Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Citreusn/an/a
BacteriaStreptomyces Coelicolorn/an/a
BacteriaStreptomyces Coelicolor DSM 40233Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Diastatochromogenes ETH 18822Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Fradiae IMRU 3535PablumGC
BacteriaStreptomyces Fradiae IMRU 3535-R7SBM Pablum GC
BacteriaStreptomyces Griseus ATCC 23345Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Griseus LP-16YD + CaCO3/SBM/Pablum GC
BacteriaStreptomyces Griseus Subsp. Griseus DSM 40236Nutrient agar CM3GC/MS
BacteriaStreptomyces Hirsutus ATCC 19773Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Hirsutus ETH 1666Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Hygroscopicus ATCC 27438Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Hygroscopicus IFO 13255Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Murinus DSM 40091Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Murinus NRRL 8171Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Odorifer IMRU 3334YD + CaCO3/SBM/Pablum GC
BacteriaStreptomyces Olivaceus ETH 7437Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Rishiriensis AMI 224Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Sp. GWS-BW-H5.n/an/a
BacteriaStreptomyces Spp. AMI 240Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Spp. AMI 243Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
BacteriaStreptomyces Sulfureusn/an/a
BacteriaStreptomyces Thermoviolaceus IFO 12382Emmerson's yeast starch agarHeadspace trapping, GC-FID/GC-MS
FungiArmillaria MelleaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
Fungi Aspergillus Nigerno
Fungi Chaetomium Globosumno
FungiPenicillium Commune PittDG18,MEAGC/MS
FungiPenicillium Discolormalt extract agar with 0.5-1.0% acetic acidTenaxGC,Chromosorb,HS-SPME, GC-MSno
FungiPenicillium Expansumn/an/a
FungiPenicillium Polonicummalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
Fungi Penicillium Sp.no
FungiPholiota SquarrosaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
Fungi Streptomyces Griseusno
FungiVerticillium LongisporumMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS


1-methoxy-3-methylbenzene

Mass-Spectra

Compound Details

Synonymous names
OSIGJGFTADMDOB-UHFFFAOYSA-N
3-Methylmethoxybenzene
m-Methylanisole
M-METHOXYTOLUENE
3-Methoxytoluene
3-Methylanisole
AC1L1OYY
m-Methyl anisole
m-Cresyl methyl ether
UI9I3Y6WTZ
Methyl m-cresyl ether
Methyl 3-methylphenyl ether
m-Cresol methyl ether
3-methoxy toluene
3-methyl anisole
Methyl m-tolyl ether
METHYL-M-TOLYL ETHER
UNII-UI9I3Y6WTZ
ACMC-1C3GF
1-Methoxy-3-methylbenzene
1-Methyl-3-methoxybenzene
3-Methyl-1-methoxybenzene
3-methoxy-1-methylbenzene
3-Cresol methyl ether
7907AF
SCHEMBL12353
NSC6255
CTK1A5099
M0151
CHEMBL349791
RP19469
AS01016
Anisole, m-methyl-
STR09347
1-Methoxy-3-methyl-benzene
3-Methylanisole, 99%
FR-1366
Jsp000166
NSC 6255
NSC-6255
DTXSID2051500
OR034385
OR145939
AK133073
SBB061028
ZINC1693360
A800280
SC-22692
ANW-14378
SCHEMBL12015250
CJ-06539
CJ-28311
AJ-30191
TRA0054603
KB-48840
LABOTEST-BB LTBB003020
LS-20215
MFCD00008395
ZINC01693360
BDBM50008537
TR-000255
ST51047105
ST24038069
AI3-19476
RTR-000255
DB-012728
AKOS000121157
W-108936
I01-5100
FT-0628957
Benzene, 1-methoxy-3-methyl-
100-84-5
MCULE-7649681864
EINECS 202-893-4
MolPort-001-768-406
InChI=1/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H
IUPAC name1-methoxy-3-methylbenzene
SMILESCC1=CC(=CC=C1)OC
InchiInChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3
FormulaC8H10O
PubChem ID7530
Molweight122.167
LogP2.33
Atoms19
Bonds19
H-bond Acceptor1
H-bond Donor0
Chemical Classificationbenzenoids ethers ketones

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungin/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiNoneFortywoodland of the Basilicata regionMauriello et al., 2004
FungiAspergillus Candiduscompost Fischer et al. 2014
FungiPenicillium Expansumcompost Fischer et al. 2014
FungiTuber Aestivumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber BorchiiT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
FungiTuber Brumalen/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Melanosporumn/aAgricultural Centre of Castilla and León Community (Monasterio de la Santa Espina, Valladolid, Spain) and Navaleno (Soria, Spain).Diaz et al., 2003
FungiTuber Mesentericumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
Fungi Aspergillus ClavatusSeifert and Kling 1982
Fungi Penicillium CommuneNilsson et al. 1996
FungiPenicillium Commune Pittnain dry-cured meat products, cheeseSunesson et al., 1995
FungiPenicillium ExpansumAzeem et al. 2013
FungiTuber Brumalen/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber Mesentericumn/aAyme Truffe of Grignan, 26230 France March et al., 2006
FungiTuber MiesentericumNoneNone March et al., 2006
FungiAmpelomyces Sp. F-a-3nanaNaznin et al., 2014
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiNonemicroextraction–gas chromatography–mass spectrometry analysis (SPME–GC–MS)No
FungiAspergillus Candidusyest extract sucroseTenax/GC-MSno
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno
FungiTuber Aestivumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber BorchiiYes
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Melanosporumn/an/a
FungiTuber Mesentericumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
Fungi Aspergillus Clavatusno
Fungi Penicillium Communeno
FungiPenicillium Commune PittMEAGC/MS
FungiPenicillium Expansumyes
FungiTuber Brumalen/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber Mesentericumn/aPressure balanced head-space sampling and GC/TOF-MS
FungiTuber MiesentericumNonePressure balanced head-space sampling and GC/TOF-MSNo
FungiAmpelomyces Sp. F-a-3naSPME-GC/MSNo


Compound Details

Synonymous names
Ethenylbenzene
Phenylethylene
Styrene-divinylbenzene Copolymer
Ethylbenzene alkylate
Phenethylene
Phenylethene
Vinylbenzene
Cinnamenol
Cinnaminol
Ethylenated benzene
POLYSTYRENE
Vinylbenzen
Vinylbenzol
Annamene
Cinnamene
Cinnamol
Polysorb
PPBRXRYQALVLMV-UHFFFAOYSA-N
Styrolene
Styropol
Styropor
Vinyl-polystyrene
CARINE
phenyl ethylene
Phenylethylene, inhibited
Polystyrene, hydrogenated
Stirolo
Styreen
Styren
STYRENE
Styrene monomer
Styrene polymer
Styrol
Styrole
Styron
Vinyl benzene
Vinyl-benzene
Vinylbenzene, inhibited
Polystyrene, atactic
Polystyrene,flame retarding and impact resistant
Styrene polymer-bound
Styropol SO
viny lbenzol
Styrene, analytical standard
AC1L1OWJ
AC1Q2AAB
Styrene monomer, inhibited
p-vinyl benzene
TRANS-STYRENE-BETA-D
Vinylbenzen [Czech]
Vinylbenzen [Dutch]
Benzene, ethenyl-
BETA-CIS-STYRENE-D
Ethylene, phenyl-
Stirolo [Italian]
Styrene (monomer)
Benzene, vinyl-
KSC176E4F
Styreen [Dutch]
Styrol (German)
Styrol [German]
8053AF
Styren [Czech]
Styrene, >=99%
UN2055
Benzene, ethenyl-, homopolymer
CCRIS 564
CTK0H6242
Diarex hf 77
HSDB 171
S0095
S0651
BIDD:ER0247
CHEMBL285235
LS-304
NSC62785
RP18837
Styropol (Salt/Mix)
Styropor (Salt/Mix)
44LJ2U959V
Benzene, ethenyl-, homopolymer, hydrogenated
C07083
C19506
Polystyrene high Mol. Wt.
Styron (Salt/Mix)
WLN: 1U1R
ZINC968269
DTXSID2021284
FEMA Number 3234
OR034234
OR192559
OR211724
OR242081
OR245032
OR247888
OR328508
Polystyrene med Mol. Wt.
STL283958
ZB015538
A800199
CHEBI:27452
DSSTox_CID_1284
ETHENYL, 2-PHENYL-
NCI-C02200
UNII-44LJ2U959V
AN-24550
ANW-14280
BP-13451
CJ-04646
DSSTox_GSID_21284
KB-60631
NSC 62785
NSC-62785
SC-75569
TRA0031624
DSSTox_RID_76057
MFCD00008612
MFCD00084450
Polystyrene latex microsphere, 1 micron, dry form
AI3-24374
RT-000109
AKOS000119972
Benzene-d5, ethenyl-d3-
I01-4405
ZINC112958499
FEMA No. 3233
FT-0659991
FT-0689054
Bulstren K-525-19
Z966690906
Styrene Resin (Med.M.Wt.)
Tox21_113245
Tox21_200808
100-42-5
F1908-0130
Diarex hf 77 (Salt/Mix)
9003-53-6
9044-64-8
9055-91-8
MCULE-4715354738
NCGC00091056-01
NCGC00091056-02
NCGC00091056-03
NCGC00091056-04
NCGC00091056-05
NCGC00258362-01
Styrene solution, certified reference material, 200 mug/mL in methanol
CAS-100-42-5
EINECS 202-851-5
EINECS 273-493-5
Styrene, SAJ first grade, >=99.0%
11120-46-0
12627-11-1
12770-88-6
25038-60-2
25086-18-4
39470-87-6
40494-15-3
51609-83-7
51609-87-1
52932-49-7
53112-49-5
53986-84-8
54578-24-4
54596-41-7
55128-06-8
55465-00-4
56451-72-0
56748-62-0
57657-06-4
58033-91-3
60120-16-3
60328-46-3
60880-98-0
61584-89-2
61584-90-5
63849-49-0
68441-35-0
78354-47-9
79637-11-9
81834-12-0
86090-91-7
98444-30-5
POLY(1-PHENYL-2,2-ETHANEDIYL))
Polystyrene latex microsphere, 1 micron, 10 wt% dispersion in water
Polystyrene latex microsphere, 2 micron, 10 wt% dispersion in water
Styrene, 99%, stabilized 100ml
Styrene, ReagentPlus(R), 99.9%
UN 2055 (Salt/Mix)
EC 202-851-5
105270-05-1
110866-50-7
120037-99-2
120534-26-1
124229-31-8
124229-48-7
131495-39-1
137262-45-4
144637-93-4
149212-19-1
155197-45-8
157243-21-5
157929-02-7
161776-45-0
171022-02-9
171022-09-6
172641-48-4
172867-64-0
219782-52-2
260975-79-9
359762-95-1
360046-70-4
373601-20-8
441772-62-9
471865-10-8
487021-46-5
644984-36-1
726192-11-6
730985-59-8
851588-70-0
852837-17-3
5487-EP2269995A1
5487-EP2270101A1
5487-EP2270113A1
5487-EP2272832A1
5487-EP2272849A1
5487-EP2272935A1
5487-EP2275418A1
5487-EP2277945A1
5487-EP2280014A2
5487-EP2284165A1
5487-EP2287168A2
5487-EP2289883A1
5487-EP2289896A1
5487-EP2292593A2
5487-EP2295415A1
5487-EP2295420A1
5487-EP2295426A1
5487-EP2295427A1
5487-EP2295438A1
5487-EP2298313A1
5487-EP2298743A1
5487-EP2298753A1
5487-EP2301924A1
5487-EP2305668A1
5487-EP2305685A1
5487-EP2305686A1
5487-EP2308832A1
5487-EP2308857A1
5487-EP2308865A1
5487-EP2309584A1
5487-EP2311796A1
5487-EP2311797A1
5487-EP2311798A1
5487-EP2311799A1
5487-EP2311804A2
5487-EP2314577A1
5487-EP2314579A1
5487-EP2380568A1
5487-EP2380867A1
MolPort-001-779-766
1083095-63-9
1160710-79-1
1161074-30-1
1187742-34-2
1191987-17-3
1198090-46-8
1227265-55-5
1263545-74-9
Polystyrene latex microsphere, 1 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 2 micron, 2.5 wt% dispersion in water
Styrene monomer, inhibited [UN2055] [Flammable liquid]
Styrene, 99.5% stab. with 4-tert-Butylcatechol
37291-EP2311802A1
37291-EP2311803A1
Styrene, ReagentPlus(R), contains 4-tert-butylcatechol as stabilizer, >=99%
Polystyrene (100-200 mesh, PEG crosslinked)
117294-EP2275408A1
117294-EP2287158A1
117294-EP2298762A2
143365-EP2287165A2
143365-EP2287166A2
143365-EP2292620A2
Styrene monomer, inhibited [UN2055] [Flammable liquid]
Polystyrene latex microsphere, 4.5 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 6.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 0.05 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 0.10 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 0.20 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 0.50 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 0.75 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 10.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 15.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 20.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 25.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 45.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 75.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, 90.0 micron, 2.5 wt% dispersion in water
Polystyrene latex microsphere, fluorescent, 6.0 micron, 2.5 wt% dispersion in water
Polystyrene, minimum number average molecular weight (in amu), 50,000
Polystyrene standard, M.W. 1,300, Mw/Mn 1.06
Polystyrene standard, M.W. 2,000, Mw/Mn 1.10
Polystyrene standard, M.W. 2,200, Mw/Mn 1.06
Polystyrene standard, M.W. 3,350, Mw/Mn 1.10
Polystyrene standard, M.W. 4,000, Mw/Mn 1.06
Polystyrene standard, M.W. 5,200, Mw/Mn 1.06
Polystyrene standard, M.W. 13,000, Mw/Mn 1.06
Polystyrene standard, M.W. 25,000, Mw/Mn 1.06
Polystyrene standard, M.W. 30,000, Mw/Mn 1.06
Polystyrene standard, M.W. 50,000, Mw/Mn 1.06
Polystyrene standard, M.W. 65,000, Mw/Mn 1.06
Polystyrene standard, M.W. 123,000, Mw/Mn 1.08
Polystyrene standard, M.W. 170,000, Mw/Mn 1.06
Polystyrene standard, M.W. 290,000, Mw/Mn 1.06
Polystyrene standard, M.W. 400,000, Mw/Mn 1.06
Polystyrene standard, M.W. 650,000, Mw/Mn 1.06
Polystyrene standard, M.W. 900,000, Mw/Mn 1.10
Polystyrene standard, MW ~ 1,300, MW/MN = 1.06 1g
Polystyrene standard, M.W. 2,000,000, Mw/Mn 1.30
InChI=1/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H
Benzene-1,2,3,4,5-d5, 6-(ethenyl-1,2,2-d3)-
IUPAC namestyrene
SMILESC=CC1=CC=CC=C1
InchiInChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2
FormulaC8H8
PubChem ID7501
Molweight104.152
LogP2.71
Atoms16
Bonds16
H-bond Acceptor0
H-bond Donor0
Chemical Classificationalkenes benzenoids

mVOC Specific Details

Volatilization
The Henry's Law constant for styrene is reported as 2.75X10-3 atm-cu m/mole(1). This Henry's Law constant indicates that styrene is expected to volatilize from water surfaces(2). Under laboratory conditions, 50% of 2 to 10 mg styrene per liter (depth not specified) was lost by volatilization in 1 to 3 hrs in lake water samples and in 6 to 7 hrs in distilled water, respectively(3). In other studies, the level of styrene in water samples fell from 23 to 3.3 and 0.4 mg/L in 2 hrs and 7 days, respectively, and from 46 to 12.5 and 1.5 mg/L in 2 hrs and 10 days, respectively(4). These findings are relevant to surface waters but not to deeper waters(4). The volatilization half-life of styrene in Rhine River water was 14 days(5). Volatilization of styrene from moist soil surfaces would be slower than in water(4). Samples at 1.5 cm deep of a loamy soil, 26% of 2 mg/kg styrene added volatilized in 31 days(3). The transfer to the air was even slower and less extensive from deep soil(4). The potential for volatilization of styrene from dry soil surfaces may exist(SRC) based upon a vapor pressure of 6.4 mm Hg(6).
Literature: (1) Bocek K; Experimetia, Suppl 23: 231-40 (1976) (2) Lyman WJ et al; Handbook of Chemical Property Estimation Methods. Washington, DC: Amer Chem Soc pp. 15-1 to 15-29 (1990) (3) Fu MH, Alexander M; Environ Sci Technol 26: 1540-4 (1992) (4) Alexander M; Crit Rev Env Sci Technol 27: 383-410 (1997) (5) Zoeteman BCJ et al; Chemosphere 9: 231-49 (1980) (6) Chao J et al; J Phys Chem Ref Data 12: 1033-63 (1983)
Soil Adsorption
The log Koc of styrene is reported to be 2.96(1). According to a classification scheme(2), this Koc value suggests that styrene is expected to have low mobility in soil. More than 85% of styrene is sorbed in 78 hrs on samples from a sandy aquifer(3). Styrene is retained by particulates particularly in organic matter-rich soils(3). Of styrene that had been allowed to sorb for 3 days, 61.0 and 66.7% was desorbed in 16 days from soil and aquifer soils, respectively(4).
Literature: (1) Schuurmann G et al; Environ Sci Technol 40: 7005-11 (2006) (2) Swann RL et al; Res Rev 85: 17-28 (1983) (3) Fu MH, Alexander M; Environ Sci Technol 26: 1540-4 (1992) (4) Fu MH et al; Environ Toxicol Chem 13: 749-53 (1994)
Vapor Pressure
PressureReference
6.40 mm Hg at 25 deg CChao J et al; J Phys Chem Ref Data 12: 1033-63 (1983)
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaPseudomonas Aeruginosacan be used as biomarker for detection of this bacteriaYusuf et al., 2015
FungiAntrodia Cinnamomea ATCC 200183nanaLu et al., 2014
FungiFusarium Graminearum 15AcDONn/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON 1001tan/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON ZFR 29n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_4n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_5n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_6n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_7n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_8n/aBusko et al., 2014
FungiFusarium Graminearum 15AcDON_9n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1002tn/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 11791n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 1509n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON 8046n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL38369n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON NRRL6394n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 15n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 37n/aBusko et al., 2014
FungiFusarium Graminearum 3AcDON ZFR 51n/aBusko et al., 2014
FungiFusarium Graminearum NIVn/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 119n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 23n/aBusko et al., 2014
FungiFusarium Graminearum NIV ZFR 48n/aBusko et al., 2014
FungiFusarium Graminearum NIV_5n/aBusko et al., 2014
FungiFusarium Graminearum NIV_6n/aBusko et al., 2014
FungiFusarium Graminearum NIV_7n/aBusko et al., 2014
FungiFusarium Graminearum NIV_8n/aBusko et al., 2014
FungiFusarium Graminearum NIV_9n/aBusko et al., 2014
FungiPaecilomyces Variotiicompost Fischer et al. 2066
FungiPenicillium Brevicompactumcompost Fischer et al. 2066
FungiPenicillium Clavigerumcompost Fischer et al. 2066
FungiPenicillium Crustosumcompost Fischer et al. 2066
FungiPenicillium Expansumcompost Fischer et al. 2066
FungiPenicillium Glabrumcompost Fischer et al. 2066
FungiPenicillium Polonicumnawater damaged buildings, BelgiumPolizzi et al., 2012
FungiTuber Borchiin/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Brumalen/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Excavatumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaPseudomonas Aeruginosablood agar base (TSBA)SPME/GC-MS
FungiAntrodia Cinnamomea ATCC 200183PDAGC/MSYes
FungiFusarium Graminearum 15AcDONyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON 1001tayeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON ZFR 29yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_4yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_8yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 15AcDON_9yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1002tyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 11791yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 1509yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON 8046yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL38369yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON NRRL6394yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 15yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 37yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum 3AcDON ZFR 51yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIVyeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 119yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 23yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV ZFR 48yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_5yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_6yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_7yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_8yeast extract sucrose agarSPME/GC-MS
FungiFusarium Graminearum NIV_9yeast extract sucrose agarSPME/GC-MS
FungiPaecilomyces Variotiiyest extract sucroseTenax/GC-MSno
FungiPenicillium Brevicompactumyest extract sucroseTenax/GC-MSno
FungiPenicillium Clavigerumyest extract sucroseTenax/GC-MSno
FungiPenicillium Crustosumyest extract sucroseTenax/GC-MSno
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno
FungiPenicillium Glabrumyest extract sucroseTenax/GC-MSno
FungiPenicillium Polonicummalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
FungiTuber Borchiin/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Brumalen/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)
FungiTuber Excavatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene

Mass-Spectra

Compound Details

Synonymous names
Aromandendrene
Aromadendrene
ITYNGVSTWVVPIC-UHFFFAOYSA-N
AC1Q2AIY
AC1L3LWG
ACMC-20cy6a
(-)-Alloaromadendrene
CTK0G2521
(-)-Aromadendrene
PL041172
OR031367
Aromadendr-7(15)-ene
FT-0694285
Aromadendrene, (+)-
1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulene
25246-27-9
1,1,2-trimethyl-5-methylidene-decahydro-1H-cyclopropa[e]azulene
1,1,2-TRIMETHYL-5-METHYLIDENE-OCTAHYDRO-1AH-CYCLOPROPA[E]AZULENE
109119-91-7
1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-
(1aR,4aR,7R,7aR,7bS)-1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulene
1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
1,1,7-trimethyl-4-methylene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
1H-Cycloprop(e)azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR-(1aalpha,4abeta,7alpha,7abeta,7balpha))-
1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aS,7R,7aR,7bS)-(-)-
1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aR,7R,7aR,7bS)-(+)-
1,1,7-Trimethyl-4-methylenedecahydro-1H-cyclopropa[e]azulene-, [1aR-(1a.alpha.,4a.alpha.,7.alpha.,7a.beta.,7b.alpha.)]-
1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, [1aR-(1a.alpha.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]-
1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, [1aR-(1a.alpha.,4a.alpha.,7.alpha.,7a.beta.,7b.alpha.)]-
IUPAC name1,1,7-trimethyl-4-methylidene-2,3,4a,5,6,7,7a,7b-octahydro-1aH-cyclopropa[e]azulene
SMILESCC1CCC2C1C3C(C3(C)C)CCC2=C
InchiInChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h10-14H,1,5-8H2,2-4H3
FormulaC15H24
PubChem ID91354
Molweight204.357
LogP4.15
Atoms39
Bonds41
H-bond Acceptor0
H-bond Donor0
Chemical Classificationterpenes

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiAntrodia Cinnamomea ATCC 200183nanaLu et al., 2014
FungiPenicillium Expansumcompost Fischer et al. 2021
FungiTrichoderma VirideHung et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiAntrodia Cinnamomea ATCC 200183PDAGC/MSYes
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno
FungiTrichoderma VirideMalt extract agar Headspace volatiles collected with colomn/TD-GC-MSYes


1-methyl-4-(6-methylhept-5-en-2-yl)benzene

Mass-Spectra

Compound Details

Synonymous names
VMYXUZSZMNBRCN-UHFFFAOYSA-N
Curcumene
aromatic curcumene
alpha-Curcumene
aryl-curcumene
Curcumene
Ar-Curcumene
AC1L3NI1
.alpha.-Curcumene
LP102105
CHEBI:62757
644-30-4
2-Methyl-6-p-tolyl-2-heptene
2-Heptene, 2-methyl-6-p-tolyl-
1-(1,5-Dimethyl-4-hexenyl)-4-methylbenzene
1-(1,5-Dimethyl-4-hexenyl)-4-methylbenzene #
1-methyl-4-(6-methylhept-5-en-2-yl)benzene
1-(1,5-dimethyl-hex-4-enyl)-4-methyl-benzene
Benzene, 1-(1,5-dimethyl-4-hexenyl)-4-methyl-
IUPAC name1-methyl-4-(6-methylhept-5-en-2-yl)benzene
SMILESCC1=CC=C(C=C1)C(C)CCC=C(C)C
InchiInChI=1S/C15H22/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8-11,14H,5,7H2,1-4H3
FormulaC15H22
PubChem ID92139
Molweight202.341
LogP5.39
Atoms37
Bonds37
H-bond Acceptor0
H-bond Donor0
Chemical Classificationterpenes benzenoids

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiCoriolus Versicolorcolonized beetleGuevara et al 2000
FungiGanoderma Adspersumcolonized beetleGuevara et al 2000
FungiPiptoporus Betulinuscolonized beetleGuevara et al 2000
FungiAspergillus Fumigatus Strain FGSC A1163Heddergott et al. 2014
FungiTrichoderma Atroviride ATCC 74058Stoppacher et al., 2010
FungiTrichoderma Harzianum T-E5 CCTCC AF2012011n/aZhang et al., 2014
FungiGanoderma Lucidumnasaprophytic on deciduous treesZiegenbein et al., 2006
FungiPenicillium Polonicumnawater damaged buildings, BelgiumPolizzi et al., 2012
FungiTrichoderma Atroviridenawater damaged buildings, BelgiumPolizzi et al., 2012
FungiArmillaria Mellean/aMueller et al., 2013
FungiAspergillus Vesicolorcompost Fischer et al. 2029
FungiPenicillium Expansumcompost Fischer et al. 2029
FungiPholiota Squarrosan/aMueller et al., 2013
FungiStropharia Rugosoannulatan/aMueller et al., 2013
FungiTrichoderma Viriden/aMueller et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiCoriolus Versicolorsteam destillation, GC-Mno
FungiGanoderma Adspersumsteam destillation, GC-Mno
FungiPiptoporus Betulinussteam destillation, GC-Mno
FungiAspergillus Fumigatus Strain FGSC A1163Brian`s broth, AMM, RPMI 1668SPME / GC-MS
FungiTrichoderma Atroviride ATCC 74058Potato dextrose agarHS-SPME/GC-MS no
FungiTrichoderma Harzianum T-E5 CCTCC AF2012011Minimal mediaSPME/GC-MS
FungiGanoderma LucidumnaGC/MSNo
FungiPenicillium Polonicummalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
FungiTrichoderma Atroviridemalt extract agar; potato dextrose agar; water agar; yeast extract agar; Czapek agarSPME-GC/MSNo
FungiArmillaria MelleaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiAspergillus Vesicoloryest extract sucroseTenax/GC-MSno
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno
FungiPholiota SquarrosaMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiStropharia RugosoannulataMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS
FungiTrichoderma VirideMelin-Nor krans synthetic medium (modified)Headspace trapping ( using stir bar sorptive extraction )/ GC-MS


2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-ol

Compound Details

Synonymous names
GFJIQNADMLPFOW-VNHYZAJKSA-N
Elemol
ALPHA-ELEMOL
AC1L3NHY
AC1Q718J
.beta.-Elemol
L92AJ7G06I
SCHEMBL310097
UNII-L92AJ7G06I
CHEMBL2287241
DTXSID1052323
OR054509
OR314619
ZINC5158354
AI3-00210
639-99-6
8024-27-9
EINECS 211-360-5
CYCLOHEXANEMETHANOL,4-VINYL-A,A,4-TRIMETHYL-3-(1-METHYLVINYL)-,(1R,3S,4S)-
Cyclohexanemethanol, 4-ethenyl-alpha,alpha,4-trimethyl-3-(1-methylethenyl)-, (1R,3S,4S)-
(1S,2S,4R)-(-)-alpha,alpha-Dimethyl-1-vinyl-o-menth-8-ene-4-methanol
Cyclohexanemethanol, 4-ethenyl-alpha,alpha,4-trimethyl-3-(1-methylethenyl)-, (1theta-(1alpha,3alpha,4beta))-
Cyclohexanemethanol, 4-ethenyl-alpha,alpha,4-trimethyl-3-(1-methylethenyl)-, (1R-(1alpha,3alpha,4beta))-
2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-ol
2-[(1r,3s,4s)-4-ethenyl-4-methyl-3-(prop-1-en-2-yl)cyclohexyl]propan-2-ol
IUPAC name2-[(1R,3S,4S)-4-ethenyl-4-methyl-3-prop-1-en-2-ylcyclohexyl]propan-2-ol
SMILESCC(=C)C1CC(CCC1(C)C=C)C(C)(C)O
InchiInChI=1S/C15H26O/c1-7-15(6)9-8-12(14(4,5)16)10-13(15)11(2)3/h7,12-13,16H,1-2,8-10H2,3-6H3/t12-,13+,15-/m1/s1
FormulaC15H26O
PubChem ID92138
Molweight222.372
LogP3.69
Atoms42
Bonds42
H-bond Acceptor1
H-bond Donor1
Chemical Classificationterpenes alcohols

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Expansumcompost Fischer et al. 2028
FungiPenicillium Glabrumcompost Fischer et al. 2028
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno
FungiPenicillium Glabrumyest extract sucroseTenax/GC-MSno


(1E,5E)-1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene

Mass-Spectra

Compound Details

Synonymous names
GXEGJTGWYVZSNR-LBJJKJHXSA-N
Germacrene B
AC1NQYKJ
trans,trans-germacrene B
CHEMBL448125
CHEBI:5337
C09672
OR225230
(E,E)-germacrene B
(1E,4E)-germacrene B
LMPR0103090007
15423-57-1
1,5-Dimethyl-8-(1-methylethylidene)-1,5-cyclodecadiene
1,5-Dimethyl-8-(1-methylethylidene)-1,5-cyclodecadiene #
Germacra-1(10),4,7(11)-triene
(1E,5E)-8-isopropylidene-1,5-dimethylcyclodeca-1,5-diene
(E,E)-1,5-Dimethyl-8-(1-methylethylidene)-1,5-cyclodecadiene
(1E,5E)-1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene
(E,E)-germacra-1(10),4,7(11)-triene
(1E,5E)-1,5-dimethyl-8-(propan-2-ylidene)cyclodeca-1,5-diene
(1E,4E)-germacra-1(10),4,7(11)-triene
Germacra-1(10),4,7(11)-triene, (E,E)-
1,5-Cyclodecadiene, 1,5-dimethyl-8-(1-methylethylidene)-, (E,E)-
1,5-Cyclodecadiene, 1,5-dimethyl-8-(1-methylethylidene)-, (1E,5E)-
IUPAC name(1E,5E)-1,5-dimethyl-8-propan-2-ylidenecyclodeca-1,5-diene
SMILESCC1=CCCC(=CCC(=C(C)C)CC1)C
InchiInChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6+,14-9+
FormulaC15H24
PubChem ID5281519
Molweight204.357
LogP4.78
Atoms39
Bonds39
H-bond Acceptor0
H-bond Donor0
Chemical Classificationterpenes

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPaecilomyces Variotiicompost Fischer et al. 2036
FungiPenicillium Expansumcompost Fischer et al. 2036
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPaecilomyces Variotiiyest extract sucroseTenax/GC-MSno
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno


Octan-3-yl Acetate

Mass-Spectra

Compound Details

Synonymous names
STZUZYMKSMSTOU-UHFFFAOYSA-N
AC1LAVBO
Amyl ethyl carbinyl acetate
3-OCTYLACETATE
1-Ethylhexyl acetate
3-Octanol acetate
3-OCTANYL ACETATE
n-Amyl ethyl carbonyl acetate
3-Octyl acetate
1-Ethylhexyl acetate #
1-Ethyl hexyl acetate
Acetic acid 1-ethylhexyl ester
Oct-3-yl ethanoate
Octan-3-ol acetate
octan-3-yl acetate
3-Octanol, acetate
CTK6D6924
SCHEMBL112743
Acetic acid, 1-ethylhexyl ester
OR031429
LS-3008
ACM4864613
AN-19084
3-Octyl acetate (natural)
KB-33049
3-Octanol, 3-acetate
FEMA No. 3583
FT-0616286
(+)-3-octyl acetate
4864-61-3
EINECS 225-471-1
50373-56-3
3-Octyl acetate, >=98%, FCC, FG
3-Octyl acetate, natural (US), >=97%, FG
IUPAC nameoctan-3-yl acetate
SMILESCCCCCC(CC)OC(=O)C
InchiInChI=1S/C10H20O2/c1-4-6-7-8-10(5-2)12-9(3)11/h10H,4-8H2,1-3H3
FormulaC10H20O2
PubChem ID521238
Molweight172.268
LogP3.07
Atoms32
Bonds31
H-bond Acceptor1
H-bond Donor0
Chemical Classificationesters

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Expansumn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Expansumwett wall papern/a


Compound Details

Synonymous names
Bicycloelemene
IUPAC name
SMILES
Inchi
Formula
PubChem ID101973934
Molweight204.357
LogP4.32
Atoms39
Bonds40
H-bond Acceptor0
H-bond Donor0
Chemical Classificationterpenes

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Expansumcompost Fischer et al. 2031
BacteriaChondromyces Crocatusn/aSchulz and Dickschat, 2007
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno
BacteriaChondromyces Crocatusn/an/a


2,5,5,8a-tetramethyl-3,4,4a,6-tetrahydro-2H-chromene

Mass-Spectra

Compound Details

Synonymous names
IVTQSEFLDHBCDZ-UHFFFAOYSA-N
Dihydroedulan IIA
Dihydroedulan II
AC1LAX0W
CTK2H2145
HE149955
HE042032
DTXSID80334976
EINECS 255-491-6
72746-44-2
41678-32-4
2,5,5,8a-tetramethyl-3,4,4a,6-tetrahydro-2H-chromene
2,5,5,8A-TETRAMETHYL-3,4,4A,6-TETRAHYDRO-2H-1-BENZOPYRAN
2,5,5,8a-Tetramethyl-3,4,4a,5,6,8a-hexahydro-2H-chromene #
2H-1-Benzopyran, 3,4,4a,5,6,8a-hexahydro-2,5,5,8a-tetramethyl-
(2alpha,4aalpha8aalpha)-3,4,4a,5,6,8a-Hexahydro-2,5,5,8a-tetramethyl-2H-1-benzopyran
2H-1-BENZOPYRAN,3,4,4A,5,6,8A-HEXAHYDRO-2,- 5,5,8A-TETRAMETHYL-,(2S,4AR,8AS)-
2H-1-Benzopyran, 3,4,4a,5,6,8a-hexahydro-2,5,5,8a-tetramethyl-(2.alpha.,4a.alpha.,8a.alpha.)-
2H-1-Benzopyran, 3,4,4a,5,6,8a-hexahydro-2,5,5,8a-tetramethyl-, (2.alpha.,4a.beta.,8a.beta.)-
IUPAC name2,5,5,8a-tetramethyl-3,4,4a,6-tetrahydro-2H-chromene
SMILESCC1CCC2C(CC=CC2(O1)C)(C)C
InchiInChI=1S/C13H22O/c1-10-6-7-11-12(2,3)8-5-9-13(11,4)14-10/h5,9-11H,6-8H2,1-4H3
FormulaC13H22O
PubChem ID522517
Molweight194.318
LogP3.34
Atoms36
Bonds37
H-bond Acceptor1
H-bond Donor0
Chemical Classificationterpenes ethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiPenicillium Expansumcompost Fischer et al. 2030
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiPenicillium Expansumyest extract sucroseTenax/GC-MSno


Compound Details

Synonymous names
Neosolaniol
Neozolaniol
AC1L2IEW
Solaniol (sesquiterpene)
AC1Q5X1B
Solaniol (VAN)
PL002563
LS-157014
NSC 197212
BRN 3657281
4-beta,15-Diacetoxy-3-alpha,8-alpha-dihydroxy-12,13-epoxytrichothec-9-ene
Trichothec-9-ene, 12,13-epoxy-4-beta,15-diacetoxy-3-alpha,8-alpha-dihydroxy-
Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate
Trichothec-9-ene-3-alpha,4-beta,8-alpha,15-tetrol, 12,13-epoxy-, 4,15-diacetate
(2|A,3|A,4|A,5|A,6|A,8|A,11xi,12r)-3,8-dihydroxy-12,13-epoxytrichothec-9-ene-4,15-diyl diacetate
[(1'R,2R,2'S,4'R,9'S,10'S,11'R)-11'-(ACETYLOXY)-4',10'-DIHYDROXY-1',5'-DIMETHYL-8'-OXASPIRO[OXIRANE-2,12'-TRICYCLO[7.2.1.0(2),?]DODECAN]-5'-EN-2'-YL]METHYL ACETATE
IUPAC name
SMILESCC1=CC2C(CC1O)(C3(C(C(C(C34CO4)O2)O)OC(=O)C)C)COC(=O)C
InchiInChI=1S/C19H26O8/c1-9-5-13-18(6-12(9)22,7-24-10(2)20)17(4)15(26-11(3)21)14(23)16(27-13)19(17)8-25-19/h5,12-16,22-23H,6-8H2,1-4H3/t12-,13?,14+,15+,16+,17+,18+,19-/m1/s1
FormulaC19H26O8
PubChem ID72650
Molweight382.409
LogP-0.85
Atoms53
Bonds56
H-bond Acceptor6
H-bond Donor2
Chemical Classificationterpenes

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiAspergillus Fumigatusn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al., 2008
FungiAspergillus Versicolorn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al., 2008
FungiCladosporium Cladosporoidesn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al., 2008
FungiPenicillium Chrysogenumn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al., 2008
FungiPenicillium Expansumn/aLandes-Gesundheitsamt Stuttgart, GermanyMatysik et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiAspergillus Fumigatuswett wall papern/a
FungiAspergillus VersicolorDG 18 agar (dichloran chloramphenicol) n/a
FungiCladosporium Cladosporoideswett wall papern/a
FungiPenicillium ChrysogenumDG 18 agar (dichloran chloramphenicol) n/a
FungiPenicillium Expansumwett wall papern/a