Results for:
chemical Classification: thioethers

Methylsulfanyl(methylsulfinyl)methane

Mass-Spectra

Compound Details

Synonymous names
methanesulfinyl(methylsulfanyl)methane
Methanesulfinyl-methylsulfanyl-methane
Methyl methylmercaptomethyl sulfoxide
methyl methylsulphinylmethyl sulphide
methylsulfanyl(methylsulfinyl)methane
methyl methylsulfinylmethyl sulfide
Methyl methylthiomethyl sulphoxide
Methylsulfinyl(methylthio)methane
Methyl methylthiomethyl sulfoxide
methyl (methylthiomethyl)sulphoxide
OTKFCIVOVKCFHR-UHFFFAOYSA-N
methyl methylsulfinyl-methyl sulfide
methylsulfinyl (methylthio)methane
Formaldehyde Dimethyl Dithioacetal S-Oxide
FAMSO
(Methylsulfanyl)(methylsulfinyl)methane
(Methylthio)dimethyl sulfoxide
Formaldehyde dimethyl mercaptal S-oxide
Formaldehyde methyl mercaptal S-oxide
Methyl((methylsulfinyl)methyl)sulfane
methyl (methylthiomethyl) sulphoxide
Methyl (methylsulfinyl)methyl sulfide
Methyl (methylthiomethyl) sulfoxide
Methyl (methylthio)methyl sulfoxide
(Methylsulfinyl)(methylthio)methane
Sulfide, methyl (methylsulfinyl)methyl
AC1L40OD
(Methylsulfanyl)(methylsulfinyl)methane;(methylsulfinyl)(methylthio)-methan
M0805
CTK4H0906
Methane,(methylsulfinyl)(methylthio)-
SCHEMBL364365
RL03236
ACMC-209i1t
A23492
OR259344
OR012361
NSC181492
X-3724
ANW-27663
BP-12695
Methane, (methylsulfinyl)(methylthio)-
SC-87090
KB-54793
MFCD00002091
DB-026948
NSC 181492
NSC-181492
TR-014039
AKOS000278611
J-522615
FT-0628753
MCULE-3167702486
EINECS 251-577-2
95833-60-6
33577-16-1
MolPort-006-126-736
Microorganism:

Yes

IUPAC namemethylsulfanyl(methylsulfinyl)methane
SMILESCSCS(=O)C
InchiInChI=1S/C3H8OS2/c1-5-3-6(2)4/h3H2,1-2H3
FormulaC3H8OS2
PubChem ID99129
Molweight124.22
LogP-0.56
Atoms14
Bonds13
H-bond Acceptor1
H-bond Donor0
Chemical Classificationsulfoxides thioethers sulfur compounds

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber Magnatumn/aItalian geographical areas ( Umbria, Piedmont, Marche, Emilia Romagna, Border region area between Emilia Romagna and Marche, Tuscany, Molise)Gioacchini et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


1-methylsulfanylpentan-3-one

Compound Details

Synonymous names
LEZZIANNWFYCND-UHFFFAOYSA-N
AC1LAWNK
1-methylsulfanylpentan-3-one
CTK1J4352
Ethyl 2-(methylthio)ethyl ketone
1D904C7W5B
OR128508
UNII-1D904C7W5B
DTXSID80334890
SCHEMBL12943418
1-(Methylthio)-3-pentanone
1-(Methylthio)pentan-3-one
1-(Methylsulfanyl)-3-pentanone #
AKOS013484784
3-Pentanone, 1-(methylthio)-
66735-69-1
Microorganism:

Yes

IUPAC name1-methylsulfanylpentan-3-one
SMILESCCC(=O)CCSC
InchiInChI=1S/C6H12OS/c1-3-6(7)4-5-8-2/h3-5H2,1-2H3
FormulaC6H12OS
PubChem ID522224
Molweight132.22
LogP1.86
Atoms20
Bonds19
H-bond Acceptor1
H-bond Donor0
Chemical Classificationsulfur compounds thioethers ketones

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBurkholderia Ambifaria LMG 19467Groenhagen et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBurkholderia Ambifaria LMG 19467Luria-Bertani medium, Malt ExtractYes


1-methylsulfanylpentane

Mass-Spectra

Compound Details

Synonymous names
Methylthiapentane
1-methylsulfanylpentane
FOJGPFUFFHWGFQ-UHFFFAOYSA-N
Amyl methylsulfide
Methyl pentyl sulphide
Pentyl methyl sulfide
METHYL PENTYL SULFIDE
Amyl methyl sulfide
2-Thiaheptane
AC1Q2WOT
Methyl n-pentyl sulfide
ACMC-1BVUN
n-Amyl methyl sulfide
Sulfide, methyl pentyl
Methyl n-amyl sulfide
1-(Methylsulfanyl)pentane
AC1L26A0
1-(Methylthio)pentane
1-(Methylsulfanyl)pentane #
7567AF
CTK6E1704
A0452
SCHEMBL198977
NSC164935
OR024972
SCHEMBL7096729
LP077525
ZINC1644625
KB-47394
ACM1741839
ANW-22699
FCH1115986
DTXSID00169762
CC-32418
CJ-26539
MFCD00027274
C-00725
NSC-164935
TC-111444
AKOS024429053
FT-0633813
Pentane, 1-(methylthio)-
I14-56809
MCULE-6566108868
1741-83-9
MolPort-003-909-485
InChI=1/C6H14S/c1-3-4-5-6-7-2/h3-6H2,1-2H
Microorganism:

Yes

IUPAC name1-methylsulfanylpentane
SMILESCCCCCSC
InchiInChI=1S/C6H14S/c1-3-4-5-6-7-2/h3-6H2,1-2H3
FormulaC6H14S
PubChem ID15620
Molweight118.24
LogP2.89
Atoms21
Bonds20
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds thioethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber Magnatumn/aItalian geographical areas (Umbria, Marche)Gioacchini et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


1-benzothiophene

Mass-Spectra

Compound Details

Synonymous names
Benzothiofuran
BENZOTHIOPHENE
Benzothiophen
benzthiophene
Thianaphtene
Thianaphthen
Thianaphthene
Thianapthene
Thionaphthene
benzothiole
FCEHBMOGCRZNNI-UHFFFAOYSA-N
1-Benzothiophene
1-benzothiophen
1-Thiaindene
AC1Q7FWQ
BENZO(B)THIOPHENE
Benzo[b]thiophene
benzo2,3thiophene
C8H6S
AC1L1OA1
Benzothiophene (VAN)
2,3-Benzothiophene
benzo[b]-thiophene
SCHEMBL7023
Thianaphthene, 95%
Thianaphthene, 98%
K725
KSC119A3H
ACMC-1C0G7
CHEMBL87112
PubChem13545
B0093
ACT02274
BIDD:GT0845
EBD35263
LS40109
NSC47196
RP20160
CS-D1193
DTXSID2052736
HE000599
HE295436
HE295437
PS-5775
SBB055961
STK053859
A845195
B-3825
CHEBI:35858
ZINC1679161
073790YQ2G
AJ-29566
AK-44148
AN-42721
ANW-40379
BR-44148
CJ-27504
GEO-00284
KB-47714
NSC 47196
NSC-47196
SC-15696
SC-17616
TL8005980
BDBM50167948
MFCD00005864
ZINC01679161
AI3-15523
AM20041456
RTR-029658
ST24033336
TR-029658
UNII-073790YQ2G
AKOS005258172
I01-2465
Q-100899
FT-0085066
95-15-8
Z940713406
2,3-Dihydro-1-benzothiophene-3-ylium
EN300-36787
Benzo[b]thiophene, 98% 5g
MCULE-7277751906
EINECS 202-395-7
11095-43-5
MolPort-001-738-534
25951-EP2269978A2
25951-EP2269985A2
25951-EP2269991A2
25951-EP2272832A1
25951-EP2272972A1
25951-EP2272973A1
25951-EP2275401A1
25951-EP2277858A1
25951-EP2277872A1
25951-EP2277874A1
25951-EP2280000A1
25951-EP2281818A1
25951-EP2284150A2
25951-EP2284151A2
25951-EP2284152A2
25951-EP2284153A2
25951-EP2284155A2
25951-EP2284156A2
25951-EP2284157A1
25951-EP2284164A2
25951-EP2284174A1
25951-EP2284920A1
25951-EP2287140A2
25951-EP2287148A2
25951-EP2287150A2
25951-EP2287160A1
25951-EP2289871A1
25951-EP2289893A1
25951-EP2292586A2
25951-EP2292590A2
25951-EP2292592A1
25951-EP2292604A2
25951-EP2292611A1
25951-EP2292630A1
25951-EP2295419A2
25951-EP2295429A1
25951-EP2295432A1
25951-EP2295433A2
25951-EP2295503A1
25951-EP2298732A1
25951-EP2298766A1
25951-EP2298767A1
25951-EP2298770A1
25951-EP2301912A2
25951-EP2301913A1
25951-EP2301914A1
25951-EP2301916A2
25951-EP2301923A1
25951-EP2305219A1
25951-EP2305637A2
25951-EP2305644A1
25951-EP2305648A1
25951-EP2305651A1
25951-EP2305695A2
25951-EP2305696A2
25951-EP2305697A2
25951-EP2305698A2
25951-EP2308510A1
25951-EP2308562A2
25951-EP2308832A1
25951-EP2308840A1
25951-EP2308849A1
25951-EP2308850A1
25951-EP2308854A1
25951-EP2308863A1
25951-EP2311796A1
25951-EP2311797A1
25951-EP2311798A1
25951-EP2311799A1
25951-EP2311825A1
25951-EP2311828A1
25951-EP2314558A1
25951-EP2314575A1
25951-EP2314581A1
25951-EP2314587A1
25951-EP2371811A2
25951-EP2371812A1
25951-EP2371831A1
28394-EP2270505A1
28394-EP2275412A1
28394-EP2281815A1
28394-EP2305640A2
28394-EP2311828A1
28394-EP2311842A2
28394-EP2314581A1
46561-EP2272517A1
46561-EP2305250A1
46561-EP2311826A2
141883-EP2270010A1
141883-EP2292593A2
195794-EP2272972A1
195794-EP2272973A1
195794-EP2277872A1
InChI=1/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6
Microorganism:

Yes

IUPAC name1-benzothiophene
SMILESC1=CC=C2C(=C1)C=CS2
InchiInChI=1S/C8H6S/c1-2-4-8-7(3-1)5-6-9-8/h1-6H
FormulaC8H6S
PubChem ID7221
Molweight134.2
LogP2.85
Atoms15
Bonds16
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationThiophenes benzothiophenes sulfur compounds thioethers benzenoids heterocyclic compounds

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
FungiTuber BrumaleFortywoodland of the Basilicata regionMauriello et al., 2004
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes
FungiTuber Brumalemicroextraction–gas chromatography–mass spectrometry analysis (SPME–GC–MS)No


1-methylsulfanylbutane

Mass-Spectra

Compound Details

Synonymous names
1-methylsulfanylbutane
WCXXISMIJBRDQK-UHFFFAOYSA-N
Butyl methyl thioether
Methyl butyl sulfide
Butyl methyl sulphide
Butyl methyl sulfide
Methyl butyl sulphide
AC1L1ZDO
2-THIAHEXANE
n-Butyl methyl sulphide
2N5IMB9XAP
Methyl-n-butyl sulfide
Sulfide, butyl methyl
n-Butyl methyl sulfide
UNII-2N5IMB9XAP
1-(Methylthio)butane
7343AF
CTK2F3803
1-(Methylsulfanyl)butane #
B0729
SCHEMBL111229
ACMC-209n8v
.alpha.-(Methylthio)butane
OR012216
DTXSID0060852
SCHEMBL9263441
LP100174
ZINC2031624
A834026
FCH1116062
CJ-31766
ANW-34397
AN-46903
TL8004279
ZINC02031624
MFCD00015256
C-52516
ST50409849
TC-123142
I09-0126
AKOS015897438
FT-0654652
Butane, 1-(methylthio)-
628-29-5
MCULE-2799775567
EINECS 211-034-2
InChI=1/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H
Microorganism:

Yes

IUPAC name1-methylsulfanylbutane
SMILESCCCCSC
InchiInChI=1S/C5H12S/c1-3-4-5-6-2/h3-5H2,1-2H3
FormulaC5H12S
PubChem ID12339
Molweight104.21
LogP2.44
Atoms18
Bonds17
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds thioethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber MelanosporumT. melanosporum, T. borchii were collected from northern Italy (Piedmont) and T. indicum from Yunnan and Sichuan Provinces (China). Splivallo et al., 2007b
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber MelanosporumYes


1,2,4-trithiolane

Compound Details

Synonymous names
QHGFEUAAQKJXDI-UHFFFAOYSA-N
AC1L1SOA
AC1Q7G1L
OF568IX8QZ
UNII-OF568IX8QZ
CTK1A6599
HE082052
SCHEMBL1039752
1,2,4-TRITHIOLANE
DTXSID70183091
289-16-7
Microorganism:

Yes

IUPAC name1,2,4-trithiolane
SMILESC1SCSS1
InchiInChI=1S/C2H4S3/c1-3-2-5-4-1/h1-2H2
FormulaC2H4S3
PubChem ID9258
Molweight124.23
LogP1.47
Atoms9
Bonds9
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds trithiolanes thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBurkholderia Sp. AD24bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
BacteriaChryseobacterium Sp. AD48nanaTyc et al., 2015
BacteriaJanthinobacterium Sp. AD80nanaTyc et al., 2015
BacteriaTsukamurella Sp. AD106nanaTyc et al., 2015
FungiTuber Magnatumn/aItalian geographical areas ( Umbria, Piedmont, Marche, Emilia Romagna, Border region area between Emilia Romagna and Marche, Tuscany, Molise)Gioacchini et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBurkholderia Sp. AD24TSBAGC-Q-TOFno
BacteriaChryseobacterium Sp. AD48Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaJanthinobacterium Sp. AD80Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaTsukamurella Sp. AD106Tryptic soy broth agarGC/MS-Q-TOFNo
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


1,3-dithietane

Compound Details

Synonymous names
ITXACGPMGJCSKF-UHFFFAOYSA-N
AC1L37T6
1,3-Dithietane
CTK1A3751
HE082668
DTXSID10182861
287-53-6
InChI=1/C2H4S2/c1-3-2-4-1/h1-2H
Microorganism:

Yes

IUPAC name1,3-dithietane
SMILESC1SCS1
InchiInChI=1S/C2H4S2/c1-3-2-4-1/h1-2H2
FormulaC2H4S2
PubChem ID136129
Molweight92.17
LogP1.19
Atoms8
Bonds8
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds thioethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaChryseobacterium Sp. AD48nanaTyc et al., 2015
BacteriaJanthinobacterium Sp. AD80nanaTyc et al., 2015
BacteriaTsukamurella Sp. AD106nanaTyc et al., 2015
BacteriaBurkholderia Sp. AD24bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaChryseobacterium Sp. AD48Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaJanthinobacterium Sp. AD80Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaTsukamurella Sp. AD106Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaBurkholderia Sp. AD24TSBAGC-Q-TOFno


2-ethylthiophene

Mass-Spectra

Compound Details

Synonymous names
ETHYLTHIOPHENE
JCCCMAAJYSNBPR-UHFFFAOYSA-N
2-ETHYLTHIOPHENE
2-Ethylthiophene, analytical standard
2-ethyl-thiophene
AC1L21MF
AC1Q2TY3
Thiophene, ethyl-
PubChem5536
I215
ACMC-209qjc
SCHEMBL91161
KM2500
E0380
CTK1G9588
RP19077
VT20131
A10387
2-Ethylthiophene, 97%
BC210545
Thiophene, 2-ethyl-
HE347980
HE000268
ZINC2005192
ST2409968
AK-76635
TRA0093890
AC-16553
CJ-30999
AJ-32454
BR-76635
AN-47847
KB-23705
ANW-38662
ZINC02005192
MFCD00005461
ST51053474
RTR-027311
AM20110253
DB-056989
TR-027311
E5616Q8745
J-800138
J-640134
J-509337
MEt 2-Cl-4-mEtpyrimidine-6-carboxylate
I09-1097
I09-0212
AKOS005257557
UNII-E5616Q8745
4CH-015162
FT-0652034
FT-0622652
FT-0612297
EN300-21167
F0001-2170
872-55-9
EINECS 212-830-2
MolPort-000-155-381
Microorganism:

Yes

IUPAC name2-ethylthiophene
SMILESCCC1=CC=CS1
InchiInChI=1S/C6H8S/c1-2-6-4-3-5-7-6/h3-5H,2H2,1H3
FormulaC6H8S
PubChem ID13388
Molweight112.19
LogP2.84
Atoms15
Bonds15
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationThiophenes sulfur thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes


2-propylsulfanylethanol

Compound Details

Synonymous names
KCWWXXYQPUDKBX-UHFFFAOYSA-N
2-propylsulfanylethanol
2-Hydroxyethyln-propylsulfide
AC1Q2YLI
AC1L3IQL
2-Hydroxyethyl propyl sulfide
2-(Propylsulfanyl)ethanol
2-Hydroxyethyl n-propyl sulfide
T300
2-(Propylthio)ethanol
2-(Propylsulfanyl)ethanol #
ACMC-209fyz
2-propylthioethan-1-ol
P0734
CTK8B1244
.beta.-Hydroxyethyl-n-propyl sulfide
SCHEMBL178530
NSC84225
2-(N-Propylthio)Ethanol
SBB058605
OR028157
LP048599
ZINC1736716
ANW-24969
CCG-40481
DTXSID00177367
CJ-29544
NSC-84225
2-(propylsulfanyl)ethan-1-ol
ZINC01736716
MFCD00014041
DB-045998
ST50409590
TC-113714
AKOS009075549
FT-0612601
Ethanol, 2-(propylthio)-
I14-102175
MCULE-8371796663
EINECS 245-241-4
22812-90-4
Microorganism:

Yes

IUPAC name2-propylsulfanylethanol
SMILESCCCSCCO
InchiInChI=1S/C5H12OS/c1-2-4-7-5-3-6/h6H,2-5H2,1H3
FormulaC5H12OS
PubChem ID89850
Molweight120.21
LogP1.05
Atoms19
Bonds18
H-bond Acceptor1
H-bond Donor1
Chemical Classificationalcohols thioethers sulfur compounds

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber Magnatumn/aItalian geographical areas ( Piedmont)Gioacchini et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


2-methylsulfanylethanol

Mass-Spectra

Compound Details

Synonymous names
methylmercaptoethanol
beta-Methylmercaptoethanol
Methylthioethanol
S-Methylmercaptoethanol
2-methylsulphanylethanol
WBBPRCNXBQTYLF-UHFFFAOYSA-N
WBBPRCNXBQTYLF-UHFFFAOYSA-
2-methylsulfanylethanol
2-Methylmercaptoethanol
Hydroxyethyl methyl sulfide
2-Hydroxyethylmethyl sulfide
beta-Hydroxyethyl methyl sulfide
2-methylthioethanol
2-MethyIthioethanol
2-Hydroxyethyl-methylsulfide
2-methylsulfanyl-ethanol
.beta.-Methylmercaptoethanol
AC1Q7DAT
AC1Q4HEG
beta-(Methylthio)ethanol
Methyl 2-hydroxyethyl sulfide
2-methylthio ethanol
2-Hydroxyethyl methyl sulfide
C3H8OS
2-(Methylmercapto)ethanol
AC1L2W9D
2-(Methylsulfanyl)ethanol
2-[Methylmercapto]ethanol
5K6TOE95UY
ACMC-1AU7O
U461
KSC271G4F
Ethanol, 2-methylthio
.beta.-Hydroxyethyl methyl sulfide
2-(Methylthio)ethanol
UNII-5K6TOE95UY
PubChem10846
2-(Methylsulfanyl)ethanol #
NSC1902
M0358
CTK1H1342
CHEMBL277871
NE10239
2-(Methylthio) Ethanol
2-(methylthio)-ethanol
LTBB001427
.beta.-(Methylthio)ethanol
NSC 1902
NSC-1902
OR035377
OR166478
ZINC1577077
A829220
CHEBI:63861
AN-21062
ANW-31523
AB0006713
SC-19276
DTXSID90200678
CJ-05437
BDBM50026479
ZINC01577077
2-(methyl thio) ethanol
MFCD00002908
2-(methylsulfanyl)ethan-1-ol
DB-003209
AI3-17419
RTC-064076
TC-064076
KB-163514
I09-0136
AKOS009075584
2-(Methylthio)ethanol, >=99%
2-(Methylthio)ethanol, 99%
1-Hydroxy-2-(methylthio)-ethane
FT-0608861
Ethanol, 2-(methylthio)-
5271-38-5
MCULE-9706874325
EINECS 226-090-3
MolPort-001-779-998
InChI=1/C3H8OS/c1-5-3-2-4/h4H,2-3H2,1H3
Microorganism:

Yes

IUPAC name2-methylsulfanylethanol
SMILESCSCCO
InchiInChI=1S/C3H8OS/c1-5-3-2-4/h4H,2-3H2,1H3
FormulaC3H8OS
PubChem ID78925
Molweight92.16
LogP0.27
Atoms13
Bonds12
H-bond Acceptor1
H-bond Donor1
Chemical ClassificationSulfides Alcohols thioethers sulfur compounds

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaAlcaligenes Spp.n/aSchulz and Dickschat, 2007
BacteriaBacillus Spp.n/aSchulz and Dickschat, 2007
BacteriaCitrobacter Sp.n/aSchulz and Dickschat, 2007
BacteriaEnterobacter Spp.n/aSchulz and Dickschat, 2007
BacteriaKlebsiella Sp.n/aSchulz and Dickschat, 2007
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaAlcaligenes Spp.n/an/a
BacteriaBacillus Spp.n/an/a
BacteriaCitrobacter Sp.n/an/a
BacteriaEnterobacter Spp.n/an/a
BacteriaKlebsiella Sp.n/an/a


2-methylthiolan-3-one

Mass-Spectra

Compound Details

Synonymous names
blackberry thiophenone
YMZZPMVKABUEBL-UHFFFAOYSA-N
AC1L1VOS
2-Methyl-3-oxotetrahydrothiophene
2-Methyltetrahydrothiophene-3-one
2-Methyl-3-tetrahydrothiophenone
2-Methyltetrahydrothiophen-3-one
2-Methytetrahydrothiophen-3-one
KSC490E3B
2-methyl tetrahydrothiophen-3-one
ACMC-1C18M
6512AA
2-Methylthiolan-3-one
2-Methyl-3-thiolanone
Dihydro-2-methyl-3-thiophenone
CTK3J0230
M1839
NE11192
SCHEMBL441187
HE019828
SY003998
HE377731
Jsp002220
CHEBI:87506
AN-18477
KB-25138
ANW-20181
AK-58634
AB1001831
2-Methyltetrahydrothiophen-3-one, >=97%
2-Methyldihydro-3(2H)-thiophenone
2-Methyldihydrothiophen-3(2H)-one
MFCD00078280
ST24040895
DB-003629
ST51053516
RT-002151
Q-100144
I09-0483
AKOS005207154
Thiolan-3-one, 2-methyl
FT-0613086
FEMA No. 3512
Dihydro-2-methylthiophen-3(2H)-one
Dihydro-2-methyl-3(2H)-thiophenone
2-Methyltetrahydrothiophen-3-one, >=97%, FG
xI-Dihydro-2-methyl-3(2H)-thiophenone
Dihydro-3(2H)-thiophenone, 2-methyl
6694-77-5
EINECS 237-183-3
PHENOXATHIIN,2-CHLORO-8-(2-NITROETHENYL)-
74015-70-6
13679-85-1
Thiophen-3(2H)-one, dihydro-2-methyl
3(2H)-Thiophenone, dihydro-2-methyl-
MolPort-003-960-135
2-Methyl-4,5-dihydro-3(2H)-thiophenone
4,5-Dihydro-2-methylthiophen-3(2H)-one
4,5-dihydro-2-methyl-3(2H)-thiophenone
Microorganism:

Yes

IUPAC name2-methylthiolan-3-one
SMILESCC1C(=O)CCS1
InchiInChI=1S/C5H8OS/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3
FormulaC5H8OS
PubChem ID61664
Molweight116.18
LogP1.12
Atoms15
Bonds15
H-bond Acceptor1
H-bond Donor0
Chemical ClassificationSulfides Ketones sulfur compounds thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaStaphylococcus Xylosusn/aSchulz and Dickschat, 2007
BacteriaMycobacterium Bovis BCGclinical isolate,abscess,bladder cancerMellors et al. 2017
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaStaphylococcus Xylosusn/an/a
BacteriaMycobacterium Bovis BCG7H9 broth, Tween 80, glycerolTenaxGC,Chromosorb,HS-SPME, GC-MSno


2-methylthietane

Compound Details

Synonymous names
2-Methylthiacyclobutane
DUTRXPYVMIFJQZ-UHFFFAOYSA-N
alpha-methyl trimethylene sulfide
2-Methylthietane
.alpha.-Methylthietane
AC1LBM52
CTK0I2819
HE319263
Thietane, 2-methyl-
DTXSID40339962
AKOS023876003
Butane, 1,3-epithio-
17837-41-1
Microorganism:

Yes

IUPAC name2-methylthietane
SMILESCC1CCS1
InchiInChI=1S/C4H8S/c1-4-2-3-5-4/h4H,2-3H2,1H3
FormulaC4H8S
PubChem ID560338
Molweight88.17
LogP1.22
Atoms13
Bonds13
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds thioethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes


2-methylsulfanylacetic Acid

Compound Details

Synonymous names
methylmercaptoacetic acid
methylsulfenylacetic acid
HGTBAIVLETUVCG-UHFFFAOYSA-N
methylsulfanyl acetic acid
2-methylsulfanylacetic acid
MTG
2-Methylthioacetic acid
UMV7E1UCUX
AC1Q5WSQ
S-methyl-thioglycolic acid
UNII-UMV7E1UCUX
(Methylthio)acetic acid
AC1Q4H9U
ACMC-20aplh
(Methylsulfanyl)acetic acid #
AC1L2P07
2-(methylsulfanyl)acetic acid
(methylthio) acetic acid
8228AD
SCHEMBL44558
2-(methylthio)acetic acid
CTK3J7237
STR05301
ZINC901663
acetic acid,(methylthio)-
C03173
SBB053570
OR035996
NSC263480
CHEBI:47870
C-5074
DTXSID10179195
SC-52319
(Methylthio)acetic acid, 99%
Acetic acid, (methylthio)-
MFCD00075444
NSC-263480
TR-031923
ST51028400
RTR-031923
NSC 263480
DB-016680
AKOS000264309
Acetic acid,2-(methylthio)-
J-015532
I04-5112
FT-0604987
F8881-5056
MCULE-7003418159
2444-37-3
EINECS 219-483-6
MolPort-000-157-541
Microorganism:

Yes

IUPAC name2-methylsulfanylacetic acid
SMILESCSCC(=O)O
InchiInChI=1S/C3H6O2S/c1-6-2-3(4)5/h2H2,1H3,(H,4,5)
FormulaC3H6O2S
PubChem ID75551
Molweight106.14
LogP0.39
Atoms12
Bonds11
H-bond Acceptor2
H-bond Donor1
Chemical Classificationcarboxylic acids sulfur compounds thioethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
FungiTuber Magnatumn/aItalian geographical areas (Umbria, Piedmont)Gioacchini et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


2-methylthiophene

Mass-Spectra

Compound Details

Synonymous names
alpha-Methylthiophene
2-Methylthiacyclopentadiene
XQQBUAPQHNYYRS-UHFFFAOYSA-N
2-Thienylmethylidyne radical
2-methlthiophene
2-METHYLTHIOPHENE
AC1L1WOB
THIOPHENE,METHYL-
2-Methylthiophene, analytical standard
ACMC-1AVLR
2-methyl thiophene
2-methyl-thiophene
PubChem5204
Thiophene, methyl-
S816
KSC207A0T
M0635
CTK1A7009
STR03626
RP18654
LS20640
VT20139
A15646
7115JAP77A
CCRIS 2936
2-Methylthiophene, 98%
Thiophene, 2-methyl-
HE000150
HE352161
DTXSID3060291
ZINC2034789
UNII-7115JAP77A
M-3940
AJ-33011
ST2410168
SC-05307
AK-48334
AN-23674
AC-16543
TL8003617
ANW-75624
CJ-07533
KB-25596
TRA0043369
CJ-31933
2-Methylthiophene, certified reference material, TraceCERT(R)
MFCD00005451
ZINC02034789
TR-019540
LS-153136
AI3-15911
RTR-019540
DB-052725
ST51053473
AKOS000120897
Q-100634
I09-0210
BRN 0103734
TRA-0204695
FT-0613093
554-14-3
F0001-1454
MCULE-7297776024
EINECS 209-063-0
25154-40-9
MolPort-019-346-351
InChI=1/C5H6S/c1-5-3-2-4-6-5/h2-4H,1H
Microorganism:

Yes

IUPAC name2-methylthiophene
SMILESCC1=CC=CS1
InchiInChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-4H,1H3
FormulaC5H6S
PubChem ID11126
Molweight98.16
LogP2.4
Atoms12
Bonds12
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationThiophenes sulfur compounds thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes


2-pentylthiophene

Mass-Spectra

Compound Details

Synonymous names
NOYVOSGVFSEKPR-UHFFFAOYSA-N
1-Methylbutylthiophene
2-PENTYLTHIOPHENE
2-Amylthiophene
AC1L2HER
2-Pentylthiophene, AldrichCPR
2-n-Pentylthiophene
2-pentyl thiophene
2-n-Amylthiophene
L79LOS1ZKM
UNII-L79LOS1ZKM
ACMC-209kdh
P1835
X5688
CTK1D7492
OR23683
SCHEMBL176020
VT20141
LP002551
AK117060
Thiophene, 2-pentyl-
DTXSID8063628
FCH918551
CHEBI:89509
A827569
ZINC2037537
ANW-30675
AX8007027
KB-25779
CJ-32077
ST2417149
AJ-33077
ACM4861589
CC-11717
ZINC02037537
ZX-AT010367
MFCD00041017
C-03370
ST50824491
TC-119420
DB-030431
I14-8973
W-106046
AKOS006230222
FT-0613234
MCULE-5834588939
4861-58-9
EINECS 225-465-9
MolPort-001-762-988
Microorganism:

Yes

IUPAC name2-pentylthiophene
SMILESCCCCCC1=CC=CS1
InchiInChI=1S/C9H14S/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3
FormulaC9H14S
PubChem ID20995
Molweight154.27
LogP4.18
Atoms24
Bonds24
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationThiophenes thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes


2-propan-2-ylthiophene

Compound Details

Synonymous names
LOXBELRNKUFSRD-UHFFFAOYSA-N
2-Isopropylthiophene
AC1L3C3P
SCHEMBL79717
2-propan-2-ylthiophene
CTK1B3447
Thiophene, 2-isopropyl-
NE42953
AK312874
HE341932
HE119084
ZINC5761688
DTXSID00193946
2-(1-Methylethyl)-thiophene
AKOS006373922
Thiophene, (1-methylethyl)-
2-(propan-2-yl)thiophene
Z1492807261
MCULE-6525833213
4095-22-1
Thiophene, 2-(1-methylethyl)-
30229-13-1
MolPort-001-790-185
Microorganism:

Yes

IUPAC name2-propan-2-ylthiophene
SMILESCC(C)C1=CC=CS1
InchiInChI=1S/C7H10S/c1-6(2)7-4-3-5-8-7/h3-6H,1-2H3
FormulaC7H10S
PubChem ID138113
Molweight126.22
LogP3.13
Atoms18
Bonds18
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationThiophenes thioethers

mVOC Specific Details


Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes


2,3-dimethylthiophene

Mass-Spectra

Compound Details

Synonymous names
BZYUMXXOAYSFOW-UHFFFAOYSA-N
AC1L1RBO
2,3-dirnethylthiophene
2,3-Dimethylthiophene
2,3,Dimethylthiophene
2.3-Dimethylthiophene
PubChem7751
KM0719
2,3-dimethyl-thiophene
CTK1A6408
Z5548
SCHEMBL113923
PS-5890
2,3-DIMETHYLTHIOPHENE,97%
HE126885
HE019816
2,3- dimethyl-thiophene
ZINC1845895
A834280
GEO-01225
AN-46955
CJ-30170
KB-17050
DTXSID50212550
MFCD00130081
ZINC01845895
DB-021331
ST51053585
AKOS005167027
Thiophene, 2,3-dimethyl-
W-200471
FT-0609731
632-16-6
EINECS 211-170-2
MolPort-016-633-163
Microorganism:

Yes

IUPAC name2,3-dimethylthiophene
SMILESCC1=C(SC=C1)C
InchiInChI=1S/C6H8S/c1-5-3-4-7-6(5)2/h3-4H,1-2H3
FormulaC6H8S
PubChem ID34295
Molweight112.19
LogP2.91
Atoms15
Bonds15
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes


(methyldisulfanyl)-methylsulfanylmethane

Mass-Spectra

Compound Details

Synonymous names
methyldisulfanyl-methylsulfanylmethane
Methyl methylthiomethyl disulfide
(methyldisulfanyl)-methylsulfanylmethane
MYIOBINSHMEDEY-UHFFFAOYSA-N
(Methyldisulfanyl)(methylsulfanyl)methane
Methyl (methylthiomethyl) persulfide
Methyl (methylthio)methyl disulphide
AC1L3PSM
AC1Q7DTR
Methyl (methylthio)methyl disulfide
Disulfide, methyl (methylthio)methyl
OSU2L4337E
CTK4I6267
SCHEMBL563411
UNII-OSU2L4337E
NSC710988
LP057172
CHEMBL1988732
CHEBI:89632
2,4,5-Trithiahexane
2,3,5-Trithiahexane
ZINC1658755
DTXSID80195261
AB1005996
Methane, (methyldithio)(methylthio)-
NSC-710988
AKOS015950879
NCI60_039030
42474-44-2
Ethyl methyl thiomethyl disulfide; Eethyl(methyl thio) methyl disulfide; 2,3,5-Trithiahexane
Microorganism:

Yes

IUPAC name(methyldisulfanyl)-methylsulfanylmethane
SMILESCSCSSC
InchiInChI=1S/C3H8S3/c1-4-3-6-5-2/h3H2,1-2H3
FormulaC3H8S3
PubChem ID93236
Molweight140.28
LogP2.02
Atoms14
Bonds13
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationSulfides Sulfide sulfur compounds thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaCollimonas Pratensis Ter91n/aGarbeva et al., 2013
BacteriaStreptomycesJones et al. eLife 2017;6:e21738.
BacteriaPseudomonas Fluorescens R76narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S04naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Frederiksbergensis S24naphyllosphere of field-grown potato plantsHunziker et al., 2015
BacteriaPseudomonas Veronii R02narhizosphere of field-grown potato plantsHunziker et al., 2015
BacteriaDinoroseobacter Shibae Strain DFL-27n/aDickschat et al., 2005_4
BacteriaLoktanella Sp. Bio-204n/aDickschat et al., 2005_4
BacteriaStreptomyces Sp. GWS-BW-H5.n/aDickschat et al., 2005_2
BacteriaBurkholderia Ambifaria LMG 17828n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al., 2013
BacteriaBurkholderia Ambifaria LMG 19182n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al., 2013
BacteriaBurkholderia Ambifaria LMG 19467n/aBurkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical.Groenhagen et al., 2013
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaCollimonas Fungivorans Ter331sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaCollimonas Pratensis Ter91sand supplemented with artificial root exudatesHeadspace trapping/GC-MS
BacteriaStreptomycesYPD agarGCxGC-TOFMSno
BacteriaPseudomonas Fluorescens R76LB mediumGC/MSYes
BacteriaPseudomonas Frederiksbergensis S04LB mediumGC/MSYes
BacteriaPseudomonas Frederiksbergensis S24LB mediumGC/MSYes
BacteriaPseudomonas Veronii R02LB mediumGC/MSYes
BacteriaDinoroseobacter Shibae Strain DFL-27n/an/a
BacteriaLoktanella Sp. Bio-204n/an/a
BacteriaStreptomyces Sp. GWS-BW-H5.n/an/a
BacteriaBurkholderia Ambifaria LMG 17828Luria-Bertani medium, Malt Extractn/a
BacteriaBurkholderia Ambifaria LMG 19182Luria-Bertani medium, Malt Extractn/a
BacteriaBurkholderia Ambifaria LMG 19467Luria-Bertani medium, Malt Extractn/a


Bis(methylsulfanyl)methane

Mass-Spectra

Compound Details

Synonymous names
Thioformaldehyde dimethylthioacetal
Thioformaldehyde dimethylacetal
Dimethylthiomethane
Thioformaldehyde dimethyl acetal
Formaldehyde dimethyl mercaptal
LOCDPORVFVOGCR-UHFFFAOYSA-
LOCDPORVFVOGCR-UHFFFAOYSA-N
Bis[methylmercapto]methane
Bis(methylsulfanyl)methane
Bis(methylmercapto)methane
truffle sulfide
Bis(methylthio)methane
Methylenebis(methyl sulfide)
Methylenebis[methyl sulfide]
Bis(methylthio)methane, analytical standard
bis-(Methylthio)methane
CH3SCH2SCH3
AC1L25RX
ACMC-1BO6A
C3H8S2
KSC492K6D
2,4-DITHIAPENTANE
8183AA
CTK3J2561
NSC96010
SCHEMBL570237
128SGX814T
Bis(methylthio)methane, 99%
Methane, bis(methylthio)-
OR021587
DTXSID0061822
AK117057
Jsp003233
A810297
ZINC1621620
UNII-128SGX814T
NSC-96010
NSC 96010
FCH1115213
KB-48078
AN-49544
ANW-21957
CJ-26146
CJ-05802
CC-24771
ZINC01621620
MFCD00008564
C-34630
RT-000761
J-009864
AKOS015897414
Bis(methylthio)methane, >=99%, FG
I09-0173
FT-0623076
1618-26-4
EINECS 216-577-9
MolPort-003-928-139
InChI=1/C3H8S2/c1-4-3-5-2/h3H2,1-2H3
Microorganism:

Yes

IUPAC namebis(methylsulfanyl)methane
SMILESCSCSC
InchiInChI=1S/C3H8S2/c1-4-3-5-2/h3H2,1-2H3
FormulaC3H8S2
PubChem ID15380
Molweight108.22
LogP1.82
Atoms13
Bonds12
H-bond Acceptor0
H-bond Donor0
Chemical ClassificationSulfide sulfur compounds thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaBurkholderia Sp. AD24bacterial interationsrhizosphere and bulk soil of Carex arenariaTyc et al. 2017
BacteriaCollimonas Fungivorans Ter331n/aGarbeva et al., 2013
BacteriaSerratia Plymuthica PRI-2Cnamaize rhizosphere, NetherlandsGarbeva et al., 2014
BacteriaChryseobacterium Sp. AD48nanaTyc et al., 2015
BacteriaJanthinobacterium Sp. AD80nanaTyc et al., 2015
BacteriaSaccharomonospora Rectivirgula DSM 43113nasoilWilkins, 1996
BacteriaTsukamurella Sp. AD106nanaTyc et al., 2015
FungiTuber Magnatumn/aFortywoodland of the Basilicata regionMauriello et al., 2004
FungiTuber Magnatumn/aItalian geographical areas ( Umbria, Piedmont, Marche, Emilia Romagna, Border region area between Emilia Romagna and Marche, Tuscany, Molise)Gioacchini et al., 2008
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaBurkholderia Sp. AD24TSBAGC-Q-TOFno
BacteriaCollimonas Fungivorans Ter331Headspace trapping/GC-MS
BacteriaSerratia Plymuthica PRI-2Csand containing artificial root exudatesGC/MSNo
BacteriaChryseobacterium Sp. AD48Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaJanthinobacterium Sp. AD80Tryptic soy broth agarGC/MS-Q-TOFNo
BacteriaSaccharomonospora Rectivirgula DSM 43113Nutrient agar CM3GC/MS
BacteriaTsukamurella Sp. AD106Tryptic soy broth agarGC/MS-Q-TOFNo
FungiTuber Magnatumn/amicroextraction-gas chromatography-mass spectrometry analysis (SPME-GC-MS)


2,4,6-trimethyl-1,3,5-trithiane

Mass-Spectra

Compound Details

Synonymous names
Trithioacetaldehyde
alpha-Trithioacetaldehyde
Thioacetaldehyde trimer
beta-Trithioacetaldehyde
alpha-Thioacetaldehyde
Thioacetaldehyde cyclic trimer
gamma-Thioacetaldehyde
beta-Thioacetaldehyde
XQVYLDFSPBXACS-UHFFFAOYSA-N
K8GLL4NEZI
AC1L2AHW
UNII-K8GLL4NEZI
AC1Q2RK8
Thioacetaldehyde beta-form [MI]
4HQ3RWP831
UNII-C6MG282Q6S component XQVYLDFSPBXACS-FPFOFBBKSA-N
UNII-C6MG282Q6S component XQVYLDFSPBXACS-KXGDERBTSA-N
ZINC398630
UNII-4HQ3RWP831
SCHEMBL1641407
NSC227897
1,5-Trimethyl-s-trithiane
HE152492
HE038866
2,6-Trimethyl-s-trithiane
A819145
s-Trithiane,4,6-trimethyl-
NSC-227897
ZINC263584619
AKOS024337231
1,3,5-Trimethyl-S-trithiane
2,4,6-Trimethyl-s-trithiane
2765-04-0
EINECS 245-870-4
23769-39-3
23769-40-6
2E,6E-Trimethyl-1,3,5-trithiane
2alpha,4alpha,6beta-Trimethyl-1,3,5-trithiane
2,6-Trimethyl-1,3,5-trithiane
s-Trithiane, 2,4,6-trimethyl-
1,3,5-Trimethyl-2,4,6-trithiane
2,4,6-TRIMETHYL-1,3,5-TRITHIANE
1,5-Trithiane, 2,4,6-trimethyl-
beta-2,4,6-Trimethyl-1,3,5-trithiane
cis-2,4,6-Trimethyl-1,3,5-trithiane
cis,cis-2,4,6-Trimethyl-1,3,5-trithiane
1,3,5-Trithiane, 2,4,6-trimethyl-
1,3,5-Trithiane, 2,4,6-trimethyl, #2
1,3,5-Trithiane, 2,4,6-trimethyl, #1
(2alpha,4alpha,6alpha)-2,4,6-Trimethyl-1,3,5-trithiane
(2A,4A,6A)-2,4,6-TRIMETHYL-1,3,5-TRITHIANE
S-Trithiane, 2,4,6-trimethyl-, cis-2,4,cis-2,6-
1,3,5-Trithiane, 2,4,6-trimethyl-, (2alpha,4alpha,6alpha)-
InChI=1/C6H12S3/c1-4-7-5(2)9-6(3)8-4/h4-6H,1-3H
Microorganism:

Yes

IUPAC name2,4,6-trimethyl-1,3,5-trithiane
SMILESCC1SC(SC(S1)C)C
InchiInChI=1S/C6H12S3/c1-4-7-5(2)9-6(3)8-4/h4-6H,1-3H3
FormulaC6H12S3
PubChem ID17696
Molweight180.34
LogP2.39
Atoms21
Bonds21
H-bond Acceptor0
H-bond Donor0
Chemical Classificationsulfur compounds thioethers

Microorganisms emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
BacteriaClostridium Difficileoutbreak 2006 UKRees et al 2016
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
BacteriaClostridium Difficilebrain heart infusionGCxGC-TOF-MSyes