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Methyl 2-[(cyanocarbothioyl)amino]benzoate
SpectraBase Compound ID AnONriTK4KZ
InChI InChI=1S/C10H8N2O2S/c1-14-10(13)7-4-2-3-5-8(7)12-9(15)6-11/h2-5H,1H3,(H,12,15)
InChIKey HUYWXGURWGMMSK-UHFFFAOYSA-N
Mol Weight 220.25 g/mol
Molecular Formula C10H8N2O2S
Exact Mass 220.030649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hg7SqFIgxAu
Name Methyl 2-[(cyanocarbothioyl)amino]benzoate
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Formula C10H8N2O2S
InChI InChI=1S/C10H8N2O2S/c1-14-10(13)7-4-2-3-5-8(7)12-9(15)6-11/h2-5H,1H3,(H,12,15)
InChIKey HUYWXGURWGMMSK-UHFFFAOYSA-N
Molecular Weight 220.246 g/mol
SMILES N(c1c(C(=O)OC)cccc1)C(C#N)=S
SPLASH splash10-03dl-0900000000-03f972901e7af73fc517
Source of Spectrum KC-0-2101-12
Synonyms 2-[[cyano(sulfanylidene)methyl]amino]benzoic acid methyl ester Methyl 2-(cyanocarbothioylamino)benzoate
Wiley ID 784355