Results for:
PubChem ID: 18064

Methylsulfonylsulfanylmethane

Mass-Spectra

Compound Details

Synonymous names	2949-92-0 S-Methyl methanethiosulfonate Methyl methanethiosulfonate S-Methyl methanesulfonothioate Methyl methanethiolsulfonate Methanesulfonothioic acid, S-methyl ester s-methyl methanethiolsulfonate methylsulfonylsulfanylmethane Methanethiosulfonic Acid S-Methyl Ester Methyl methanesulfonothioate S-Methyl methanethiosulphonate (METHANESULFONYLSULFANYL)METHANE dimethyl thiosulfonate METHANESULFONIC ACID, THIO-, S-METHYL ESTER Methyl Methanethiosulfonate-d3 methylmethanethiosulfonate methyl methanethiolsulfate s-methyl methylthiosulfonate 55800-37-8 CHEBI:74357 NSC21545 NSC-21545 Methanethiosulfonic acid, S-methyl ester 0906Z2356U S-Methyl thiomethanesulfonate CCRIS 7217 EINECS 220-970-0 NSC 21545 s-methylmethanethiosulfonate BRN 1446059 METHYL METHANETHIO-SULFONATE UNII-0906Z2356U MeSSO2Me MFCD00007565 methyl methanethiol sulfonate methyl methanethiol-sulfonate methylsulfonylsulfanyl-methane s-methyl methanethionsulfonate 4-04-00-00031 (Beilstein Handbook Reference) SCHEMBL136797 CHEMBL1236925 DTXSID8062739 S-Methyl methanethiosulfonate, 97% BBL104000 STL557811 AKOS006221195 CS-W004461 MCULE-2094653694 METHYL METHANETHIOSULFONATE, S- METHYL METHANETHIOSULPHONATE, S- MS-20744 PD195134 A5499 AM20080910 M1382 NS00022002 EN300-132006 H10854 S-Methyl methanethiosulfonate, analytical standard J-017549 InChI=1/C2H6O2S2/c1-5-6(2,3)4/h1-2H Q27144634 S-Methyl methanethiosulfonate, purum, >=98.0% (GC) Methyl methanethiolsulfonate;S-Methyl methanethiolsulfonate inverted exclamation markY97.0%(GC),contains 5%-10%CH2Cl2 and HAc as stabilizer
Microorganism:	Yes
IUPAC name	methylsulfonylsulfanylmethane
SMILES	CSS(=O)(=O)C
Inchi	InChI=1S/C2H6O2S2/c1-5-6(2,3)4/h1-2H3
Formula	C2H6O2S2
PubChem ID	18064
Molweight	126.2
LogP	0
Atoms	6
Bonds	1
H-bond Acceptor	3
H-bond Donor	0
Chemical Classification	sulfur compounds sulfonyls
CHEBI-ID	74357
Supernatural-ID	SN0443546

mVOC Specific Details

Boiling Point	Degree Reference 266 median
MS-Links	MS-MS Spectrum 169132 MS-MS Spectrum 50974 MS-MS Spectrum 169131 MS-MS Spectrum 50975 MS-MS Spectrum 50973 MS-MS Spectrum 169133

Species emitting the compound

Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Stigmatella Aurantiaca n/a NA Schulz and Dickschat 2007 Prokaryota Loktanella Sp. n/a NA Schulz and Dickschat 2007 Prokaryota Dinoroseobacter Shibae n/a NA Schulz and Dickschat 2007 Prokaryota Loktanella Sp. n/a NA Dickschat et al. 2005_4 Prokaryota Dinoroseobacter Shibae n/a NA Dickschat et al. 2005_4 Prokaryota Stigmatella Aurantiaca n/a NA Dickschat et al. 2005_5 Prokaryota Burkholderia Sp. bacterial interations rhizosphere and bulk soil of Carex arenaria Tyc et al. 2017 Eukaryota Fusarium Sp. NA Dickschat et al. 2011 Eukaryota Penicillium Sp. NA Citron et al. 2012 Prokaryota Pseudomonas Chlororaphis na rhizosphere of field-grown potato plants Hunziker et al. 2015 Prokaryota Pseudomonas Fluorescens na rhizosphere of field-grown potato plants Hunziker et al. 2015 Prokaryota Pseudomonas Syringae na phyllosphere of field-grown potato plants Hunziker et al. 2015 Prokaryota Pseudomonas Jessenii na phyllosphere of field-grown potato plants Hunziker et al. 2015 Prokaryota Burkholderia Ambifaria n/a Burkholderia ambifaria LMG 17828 from root, LMG 19182 from rhizosphere and LMG 19467 from clinical. Groenhagen et al. 2013

Method

Kingdom Species Growth Medium Applied Method Verification Prokaryota Stigmatella Aurantiaca n/a n/a no Prokaryota Loktanella Sp. n/a n/a no Prokaryota Dinoroseobacter Shibae n/a n/a no Prokaryota Burkholderia Sp. TSBA GC-Q-TOF no Eukaryota Fusarium Sp. no Eukaryota Penicillium Sp. no Prokaryota Pseudomonas Chlororaphis LB medium GC/MS yes Prokaryota Pseudomonas Fluorescens LB medium GC/MS yes Prokaryota Pseudomonas Syringae LB medium GC/MS yes Prokaryota Pseudomonas Jessenii LB medium GC/MS yes Prokaryota Burkholderia Ambifaria Luria-Bertani medium, Malt Extract n/a no