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methyl 3-[(3-nitro-2-thienyl)sulfanyl]propanoate
SpectraBase Compound ID LpVQTJCWDTE
InChI InChI=1S/C8H9NO4S2/c1-13-7(10)3-5-15-8-6(9(11)12)2-4-14-8/h2,4H,3,5H2,1H3
InChIKey VKKAMKRVCXCYJF-UHFFFAOYSA-N
Mol Weight 247.28 g/mol
Molecular Formula C8H9NO4S2
Exact Mass 246.9973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DvuvFW1nMmR
Name methyl 3-[(3-nitro-2-thienyl)sulfanyl]propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C8H9NO4S2
InChI InChI=1S/C8H9NO4S2/c1-13-7(10)3-5-15-8-6(9(11)12)2-4-14-8/h2,4H,3,5H2,1H3
InChIKey VKKAMKRVCXCYJF-UHFFFAOYSA-N
Molecular Weight 247.283 g/mol
SMILES c1(N(=O)=O)c(scc1)SCCC(=O)OC
SPLASH splash10-0a4i-9050000000-7c03464473b37c5b7bca
Source of Spectrum D8-328-316-12
Synonyms 3-[(3-nitro-2-thiophenyl)thio]propanoic acid methyl ester methyl 3-(3-nitrothiophen-2-yl)sulfanylpropanoate
Wiley ID 1515854