Results for:
Species: Antrodia camphorata

Methyl 2-phenylacetate

Mass-Spectra

Compound Details

Synonymous names
Methyl benzeneethanoate
Methyl benzeneacetate
Methyl phenylethanoate
METHYL PHENYLACETATE
CRZQGDNQQAALAY-UHFFFAOYSA-N
Phenylacetic acid methyl
Methyl benzene acetate
Methyl phenylacetate, analytical standard
Methyl alpha-toluate
methyl phenyl acetate
Phenylacetic Acid Methyl Ester
alpha-phenylacetic acid methyl ester
AC1Q5ZUJ
Methyl 2-phenylacetate
benzene acetic acid methyl ester
Benzeneacetic acid, methyl ester
phenyl acetic acid methyl ester
Phenyl-acetic acid methyl ester
Phenylacetic acid, methyl ester
AC1L1P1D
Methyl 2-phenyl acetate
2-Phenylacetic acid methyl ester
SCHEMBL4675
Methyl alpha-toluate; Phenylacetic acid methyl ester
KSC175C1T
NSC9405
Methyl .alpha.-toluate
CTK0H5119
D4PDC41X96
P0125
EBD50083
WLN: 1OV1R
RP17360
ZINC388061
UNII-D4PDC41X96
BBL010506
DTXSID1044352
NSC-9405
NSC401667
OR034300
AK163377
SBB058223
STL146152
ZB011258
LS-2954
CHEMBL3189123
ACMC-2097v7
CJ-03094
SC-26761
ANW-14465
DSSTox_GSID_44352
AN-24576
AB1011175
KB-54814
MFCD00008453
DSSTox_CID_24352
ZINC00388061
BB_SC-7169
DSSTox_RID_80161
AI3-01971
RTR-000377
Acetic acid, phenyl-, methyl ester
NSC-401667
NSC 401667
ST24047740
ST50824226
TR-000377
Methyl phenylacetate, ReagentPlus(R), >=99%
I14-7331
AKOS000119976
FT-0653159
TRA-0184135
FEMA No. 2733
Tox21_300792
Methyl phenylacetate, >=98%, FCC, FG
101-41-7
Methyl phenylacetate, Vetec(TM) reagent grade, 98%
MCULE-9593207528
NCGC00254696-01
NCGC00248170-01
EINECS 202-940-9
CAS-101-41-7
EC 202-940-9
MolPort-001-788-281
InChI=1/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H
IUPAC namemethyl 2-phenylacetate
SMILESCOC(=O)CC1=CC=CC=C1
InchiInChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
FormulaC9H10O2
PubChem ID7559
Molweight150.177
LogP1.76
Atoms21
Bonds21
H-bond Acceptor1
H-bond Donor0
Chemical Classificationbenzenoids esters

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaMycobacterium Tuberculosisn/aRespiratory clinical isolates (Canterbury Health Laboratories, Christchurch, New Zealand)Syhre et al., 2008
Fungi Antrodia CamphorataChiang et al. 2013
Fungi Antrodia CinnamomeaChen et al. 2007
FungiGleophyllum OdoratumnaSachsenwald near HamburgRösecke et al., 2000
Fungi Gloeophyllum OdoratumKahlos et al. 1994
BacteriaSalinispora Tropica CNB-440namarine sedimentGroenhagen et al., 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaMycobacterium TuberculosisLoewenstein-Jensen/Glycerol, sheep blood agar and BacT/Alerts MPSolid phase micro-extraction (SPME), GC/MS-MS
Fungi Antrodia Camphoratano
Fungi Antrodia Cinnamomeano
FungiGleophyllum OdoratumnaGC/MSNo
Fungi Gloeophyllum Odoratumno
BacteriaSalinispora Tropica CNB-440seawater-based A1GC/MS


2,4,5-trimethoxybenzaldehyde

Mass-Spectra

Compound Details

Synonymous names
Asaronaldehyde
Asarylaldehyde
Azarylaldehyde
Asaraldehyde
Asarylaldehyde, analytical standard
IAJBQAYHSQIQRE-UHFFFAOYSA-N
Asaraldehyde-Supplied by Selleck Chemicals
Gazarin
Asaraldehyde - Asaronaldehyde
Acrolein(Propenal)
2,5-Trimethoxybenzaldehyde
3,6-Trimethoxybenzaldehyde
AC1L2GG7
ACMC-1ADV9
NDU8J2Q00D
PubChem8263
AC1Q490G
KSC236C5N
2,4,5-TRIMETHOXYBENZALDEHYDE
3,4,6-Trimethoxybenzaldehyde
UNII-NDU8J2Q00D
CTK1D6156
S2531_Selleck
SPECTRUM200208
AS02818
LS10199
NSC89299
RP25437
SCHEMBL333451
A26620
BCPP000436
CCRIS 1296
HMS1922P08
HMS2268O16
HMS3656M12
HSDB 4502
ZINC336939
2,4,5-Trimethoxy benzaldehyde
2,4,5-trimethoxy-benzaldehyde
AC-4247
BBL011033
CHEMBL1164301
CS-6035
DTXSID1022217
LS-1267
OR003780
OR147945
OR220925
PS-6109
SBB040214
ST093686
STK802187
TL806230
ZB010841
DSSTox_CID_2217
K-8969
NCI-C61632
Spectrum_000818
4CA-0107
AB1004251
AJ-19817
AK-81441
AN-12166
ANW-30143
BCP9000230
BSPBio_001639
CCG-38657
DSSTox_GSID_22217
KB-85563
KBioGR_002238
KBioSS_001298
NSC 89299
NSC-89299
PARAGOS 530447
SC-04555
ST2415708
TRA0030137
BB_SC-1446
CHEBI:113543
DSSTox_RID_76523
MFCD00003312
SPBio_000571
Spectrum2_000386
Spectrum3_000170
Spectrum4_001759
Spectrum5_000618
ZINC00336939
AI3-36671
DB-051236
HY-100580
RTR-017129
TIMTEC-BB SBB040214
TR-017129
AKOS000119399
I01-1219
KBio2_001298
KBio2_003866
KBio2_006434
KBio3_001139
Q-100162
Asaraldehyde, Asaronaldehyde, Asarylaldehyde, NSC 89299
BRN 1951403
FT-0609813
MLS002473312
MLS002695891
MLS006011864
SMR000112148
LABOTEST-BB LT00926884
LABOTEST-BB LT03330935
LABOTEST-BB LT03381259
2,4,5-Trimethoxybenzaldehyde, 98%
BCP0726000304
Benzaldehyde, 2,4,5-trimethoxy-
Tox21_400070
F2190-0582
AKOS BBS-00003175
4460-86-0
MCULE-7174618286
NCGC00091253-01
NCGC00091253-02
NCGC00091253-03
NCGC00091253-04
NCGC00091253-05
NCGC00091253-06
NCGC00091253-07
EINECS 224-713-3
14374-62-0
SDCCGMLS-0066425.P001
CAS-4460-86-0
MolPort-000-871-193
AP-065/41884113
2,4,5-Trimethoxybenzaldehyde, Vetec(TM) reagent grade, 98%
4-08-00-02715 (Beilstein Handbook Reference)
Asarylaldehyde, NSC 89299;4460-86-0
BRD-K88219015-001-02-5
InChI=1/C10H12O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H
IUPAC name2,4,5-trimethoxybenzaldehyde
SMILESCOC1=CC(=C(C=C1C=O)OC)OC
InchiInChI=1S/C10H12O4/c1-12-8-5-10(14-3)9(13-2)4-7(8)6-11/h4-6H,1-3H3
FormulaC10H12O4
PubChem ID20525
Molweight196.202
LogP1.21
Atoms26
Bonds26
H-bond Acceptor4
H-bond Donor0
Chemical Classificationbenzenoids aldehydes ethers

mVOC Specific Details

Vapor Pressure
PressureReference
1.13X10-3 mm Hg at 25 deg C (est)US EPA; Estimation Program Interface (EPI) Suite. Ver.3.12. Nov 30, 2004. Available from, as of Feb 19, 2007: http://www.epa.gov/oppt/exposure/pubs/episuitedl.htm
MS-Links
1D-NMR-Links

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungi Antrodia CamphorataChiang et al. 2013
Fungi Antrodia CinnamomeaChen et al. 2007
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungi Antrodia Camphoratano
Fungi Antrodia Cinnamomeano


2-butyl-2H-furan-5-one

Compound Details

Synonymous names
KGJZBUMJSZTLTA-UHFFFAOYSA-N
AC1Q6ATH
AC1L3TEJ
ACMC-20mct5
CTK4G4988
ACMC-20mu67
SCHEMBL9993726
HE030821
5-Butylfuran-2(5H)-one
5-butyl-5H-furan-2-one
5-butyl-2(5H)-furanone
2-butyl-2H-furan-5-one
2(5H)-Furanone,5-butyl-
EINECS 250-133-5
EINECS 274-596-8
70404-04-5
30336-14-2
131616-48-3
110013-17-7
(1)-5-Butylfuran-2(5H)-one
IUPAC name2-butyl-2H-furan-5-one
SMILESCCCCC1C=CC(=O)O1
InchiInChI=1S/C8H12O2/c1-2-3-4-7-5-6-8(9)10-7/h5-7H,2-4H2,1H3
FormulaC8H12O2
PubChem ID121779
Molweight140.182
LogP2.36
Atoms22
Bonds22
H-bond Acceptor1
H-bond Donor0
Chemical Classificationlactones heterocylic compounds alkenes esters

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungi Antrodia CamphorataChen et al.2007
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungi Antrodia Camphoratano


2-(2-methoxyphenyl)propanoate

Compound Details

Synonymous names
NUSLQDOXLCYVTQ-UHFFFAOYSA-M
methyl(2-methoxyphenyl)acetate
IUPAC name2-(2-methoxyphenyl)propanoate
SMILESCC(C1=CC=CC=C1OC)C(=O)[O-]
InchiInChI=1S/C10H12O3/c1-7(10(11)12)8-5-3-4-6-9(8)13-2/h3-7H,1-2H3,(H,11,12)/p-1
FormulaC10H11O3-
PubChem ID21643366
Molweight179.196
LogP2
Atoms24
Bonds24
H-bond Acceptor3
H-bond Donor0
Chemical Classificationbenzenoids ethers esters

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Fungi Antrodia CamphorataChiang et al. 2014
Fungi Antrodia CinnamomeaChen et al. 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Fungi Antrodia Camphoratano
Fungi Antrodia Cinnamomeano