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S-Methyl [(4-chlorobenzoyl)amino]carbonylthiocarbamate
SpectraBase Compound ID 188wSozFZ9
InChI InChI=1S/C10H9ClN2O3S/c1-17-10(16)13-9(15)12-8(14)6-2-4-7(11)5-3-6/h2-5H,1H3,(H2,12,13,14,15,16)
InChIKey FNMTYIUOLSPLIH-UHFFFAOYSA-N
Mol Weight 272.71 g/mol
Molecular Formula C10H9ClN2O3S
Exact Mass 272.002241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpPapCKSbmj
Name S-Methyl [(4-chlorobenzoyl)amino]carbonylthiocarbamate
Alternate Name(s) Carbamothioic acid, [[(4-chlorobenzoyl)amino]carbonyl]-, S-methyl ester N-[(4-chlorobenzoyl)carbamoyl]thiocarbamic acid S-methyl ester N-[[[(4-chlorophenyl)-oxomethyl]amino]-oxomethyl]carbamothioic acid S-methyl ester S-methyl N-[(4-chlorobenzoyl)carbamoyl]carbamothioate S-methyl N-[(4-chlorophenyl)carbonylcarbamoyl]carbamothioate
CAS Registry Number 79340-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9ClN2O3S
InChI InChI=1S/C10H9ClN2O3S/c1-17-10(16)13-9(15)12-8(14)6-2-4-7(11)5-3-6/h2-5H,1H3,(H2,12,13,14,15,16)
InChIKey FNMTYIUOLSPLIH-UHFFFAOYSA-N
Molecular Weight 272.706 g/mol
SMILES N(C(SC)=O)C(=O)NC(=O)c1ccc(cc1)Cl
SPLASH splash10-01pc-7910000000-3da9fe48e6b2946a1aca
Source of Spectrum HE-1982-0-0
Wiley ID 1275651