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Methyl N'-cyano-N-(4-methoxyphenyl)imidothiocarbamate
SpectraBase Compound ID EbTICbTr7IO
InChI InChI=1S/C10H11N3OS/c1-14-9-5-3-8(4-6-9)13-10(15-2)12-7-11/h3-6H,1-2H3,(H,12,13)
InChIKey WQFVSTRGXWJJLY-UHFFFAOYSA-N
Mol Weight 221.28 g/mol
Molecular Formula C10H11N3OS
Exact Mass 221.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1MNo6TItyS
Name Methyl N'-cyano-N-(4-methoxyphenyl)imidothiocarbamate
Alternate Name(s) 1-cyano-3-(4-methoxyphenyl)-2-methyl-isothiourea Isothiourea, 1-cyano-3-(4-methoxyphenyl)-2-methyl- Methyl N-cyano-N'-(4-methoxyphenyl)carbamimidothioate N-cyano-N'-(4-methoxyphenyl)carbamimidothioic acid methyl ester
CAS Registry Number 75565-12-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3OS
InChI InChI=1S/C10H11N3OS/c1-14-9-5-3-8(4-6-9)13-10(15-2)12-7-11/h3-6H,1-2H3,(H,12,13)
InChIKey WQFVSTRGXWJJLY-UHFFFAOYSA-N
Molecular Weight 221.278 g/mol
SMILES N(\C(=N/C#N)SC)c1ccc(cc1)OC
SPLASH splash10-00di-3930000000-42d43d5952d21212d7de
Source of Spectrum AD-0-2532-0
Wiley ID 1422654