Results for:
PubChem ID: 73750

S-methyl Ethanethioate

Compound Details

Synonymous names	Methylthioacetate Methyl thiolacetate Methanethiol acetate methyl ethanethioate S-METHYLTHIOACETATE OATSQCXMYKYFQO-UHFFFAOYSA-N S-Methyl ethanethioate S-Methyl thioacetate AC1L2KFM S-Methyl thioacetate, AldrichCPR S-Methyl ethanethioate # Thioacetic acid S-methyl ester Ethanethioic acid, methyl ester AC1Q68RR ACMC-1BTZ5 PF2D4MWX79 KSC493A2H Ethanethioic acid, S-methyl ester UNII-PF2D4MWX79 M2286 CTK3J3023 CH3C(O)SCH3 FCH918358 OR031401 OR224946 OR224947 DTXSID3073264 ZINC2004049 CHEBI:51280 CJ-07327 1-(methylsulfanyl)ethan-1-one AB1006061 AN-49402 CJ-30959 ZINC02004049 MFCD00014989 Ethanethioic acid,S-methyl ester (9CI) RT-001199 Q-100182 I09-0174 AKOS006229807 FT-0659567 Acetic acid, thio-, S-methyl ester S-Methyl thioacetate, natural, >=96%, FG 1534-08-3 EINECS 216-252-1 MolPort-006-113-372 InChI=1/C3H6OS/c1-3(4)5-2/h1-2H
Microorganism:	Yes
IUPAC name	S-methyl ethanethioate
SMILES	CC(=O)SC
Inchi	InChI=1S/C3H6OS/c1-3(4)5-2/h1-2H3
Formula	C3H6OS
PubChem ID	73750
Molweight	90.14
LogP	0.68
Atoms	11
Bonds	10
H-bond Acceptor	1
H-bond Donor	0
Chemical Classification	Thioesters Ester sulfur compounds

mVOC Specific Details

MS-Links

MS-MS Spectrum 132934 MS-MS Spectrum 132935 MS-MS Spectrum 132933 MS-MS Spectrum 73704 MS-MS Spectrum 73705 MS-MS Spectrum 73706

Microorganisms emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Bacteria Ralstonia Solanacearum na na Spraker et al., 2014 Bacteria Streptomyces Albidoflavus AMI 246 n/a Schoeller et al., 2002 Bacteria Streptomyces Albus IFO 13014 n/a Schoeller et al., 2002 Bacteria Streptomyces Albus Subsp. Pathocidicus IFO 13812 n/a Schoeller et al., 2002 Bacteria Streptomyces Coelicolor DSM 40233 n/a Schoeller et al., 2002 Bacteria Streptomyces Diastatochromogenes ETH 18822 n/a Schoeller et al., 2002 Bacteria Streptomyces Griseus ATCC 23345 n/a Schoeller et al., 2002 Bacteria Streptomyces Griseus IFO 13849 n/a Schoeller et al., 2002 Bacteria Streptomyces Hirsutus ETH 1666 n/a Schoeller et al., 2002 Bacteria Streptomyces Rishiriensis AMI 224 n/a Schoeller et al., 2002 Bacteria Streptomyces Thermoviolaceus IFO 12382 n/a Schoeller et al., 2002 Bacteria Chryseobacterium Sp. AD48 na na Tyc et al., 2015 Bacteria Janthinobacterium Sp. AD80 na na Tyc et al., 2015 Bacteria Pseudomonas Chlororaphis 450 na Rhizosphere of maize, Kiev region, Ukraine Popova et al., 2014 Bacteria Clostridium Difficile outbreak 2006 UK Rees et al 2016 Bacteria AMI 386 na breathing zone of a waste collection worker Wilkins, 1996 Bacteria Brevibacterium Linens n/a Schulz and Dickschat, 2007 Bacteria Collimonas Fungivorans Ter331 n/a Garbeva et al., 2013 Bacteria Collimonas Pratensis TER91 na rhizosphere of Marram grass in sandy dune soils, Netherlands Garbeva et al., 2014 Bacteria Lactococcus Lactis n/a Schulz and Dickschat, 2007 Bacteria Serratia Plymuthica PRI-2C na maize rhizosphere, Netherlands Garbeva et al., 2014 Bacteria Streptomyces Albidoflavus n/a Schulz and Dickschat, 2007 Bacteria Streptomyces Griseus Subsp. Griseus DSM 40236 na soil Wilkins, 1996 Bacteria Streptomyces Spp. n/a Schulz and Dickschat, 2007 Bacteria Thermoactinomyces Vulgaris DSM 43016 na soil Wilkins, 1996 Bacteria Clostridium Difficile R002 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R005 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R013 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R014/R020 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R026 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R027 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R078 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R087 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015 Bacteria Clostridium Difficile R107 na stool specimens, from patients infected with clostridium difficile Kuppusami et al., 2015

Method

Kingdom Species Growth Medium Applied Method Verification Bacteria Ralstonia Solanacearum Casamino Acid Peptone Glucose agar SPME-GC/MS No Bacteria Streptomyces Albidoflavus AMI 246 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Albus IFO 13014 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Albus Subsp. Pathocidicus IFO 13812 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Coelicolor DSM 40233 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Diastatochromogenes ETH 18822 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Griseus ATCC 23345 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Griseus IFO 13849 n/a n/a Bacteria Streptomyces Hirsutus ETH 1666 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Rishiriensis AMI 224 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Streptomyces Thermoviolaceus IFO 12382 Emmerson's yeast starch agar Headspace trapping, GC-FID/GC-MS Bacteria Chryseobacterium Sp. AD48 Tryptic soy broth agar GC/MS-Q-TOF No Bacteria Janthinobacterium Sp. AD80 Tryptic soy broth agar GC/MS-Q-TOF No Bacteria Pseudomonas Chlororaphis 450 LB medium SPME-GC/MS No Bacteria Clostridium Difficile brain heart infusion GCxGC-TOF-MS yes Bacteria AMI 386 Nutrient agar CM3 + 50mg/l actidione GC/MS Bacteria Brevibacterium Linens n/a n/a Bacteria Collimonas Fungivorans Ter331 Headspace trapping/GC-MS Bacteria Collimonas Pratensis TER91 sand containing artificial root exudates GC/MS No Bacteria Lactococcus Lactis n/a n/a Bacteria Serratia Plymuthica PRI-2C sand containing artificial root exudates GC/MS No Bacteria Streptomyces Albidoflavus n/a n/a Bacteria Streptomyces Griseus Subsp. Griseus DSM 40236 Nutrient agar CM3 GC/MS Bacteria Streptomyces Spp. n/a n/a Bacteria Thermoactinomyces Vulgaris DSM 43016 Nutrient agar CM3 GC/MS Bacteria Clostridium Difficile R002 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R005 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R013 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R014/R020 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R026 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R027 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R078 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R087 brain heart infusion agar with 7% horse blood PTR-ToF-MS No Bacteria Clostridium Difficile R107 brain heart infusion agar with 7% horse blood PTR-ToF-MS No