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3-(4-thiadiazolylthio)propanoic acid methyl ester
SpectraBase Compound ID HbYbcGE7B97
InChI InChI=1S/C6H8N2O2S2/c1-10-6(9)2-3-11-5-4-12-8-7-5/h4H,2-3H2,1H3
InChIKey JWERZOUVMAWFQD-UHFFFAOYSA-N
Mol Weight 204.26 g/mol
Molecular Formula C6H8N2O2S2
Exact Mass 204.00272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18UrettTxaB
Name 3-(4-thiadiazolylthio)propanoic acid methyl ester
CAS Registry Number 114393-09-8
Comments Less than 3 mono-isotopic peaks
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Formula C6H8N2O2S2
InChI InChI=1S/C6H8N2O2S2/c1-10-6(9)2-3-11-5-4-12-8-7-5/h4H,2-3H2,1H3
InChIKey JWERZOUVMAWFQD-UHFFFAOYSA-N
Molecular Weight 204.262 g/mol
SMILES c1snnc1SCCC(=O)OC
SPLASH splash10-004i-0910000000-9399b572efd25a3ac495
Source of Spectrum Y-25-1881-2
Synonyms 3-(thiadiazol-4-ylthio)propionic acid methyl ester methyl 3-(1,2,3-thiadiazol-4-ylsulfanyl)propanoate methyl 3-(thiadiazol-4-ylsulfanyl)propanoate
Wiley ID 1201162