N,N-Dimethyl-O-[4-(4'-nitrophenoxy)phenyl]thiocarbamate

SpectraBase Compound ID	KlxIpslniJJ
InChI	InChI=1S/C15H14N2O4S/c1-16(2)15(22)21-14-9-7-13(8-10-14)20-12-5-3-11(4-6-12)17(18)19/h3-10H,1-2H3
InChIKey	KPMCXHQJYGFUDZ-UHFFFAOYSA-N Google Search
Mol Weight	318.35 g/mol
Molecular Formula	C15H14N2O4S
Exact Mass	318.067428 g/mol

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SpectraBase Spectrum ID	KpAgl3jLxQF
Name	N,N-Dimethyl-O-[4-(4'-nitrophenoxy)phenyl]thiocarbamate
Alternate Name(s)	O-[4-(4-nitrophenoxy)phenyl]dimethylthiocarbamate N,N-dimethylcarbamothioic acid O-[4-(4-nitrophenoxy)phenyl] ester O-[4-(4-nitrophenoxy)phenyl] N,N-dimethylcarbamothioate
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H14N2O4S
InChI	InChI=1S/C15H14N2O4S/c1-16(2)15(22)21-14-9-7-13(8-10-14)20-12-5-3-11(4-6-12)17(18)19/h3-10H,1-2H3
InChIKey	KPMCXHQJYGFUDZ-UHFFFAOYSA-N
Molecular Weight	318.347 g/mol
SMILES	c1(N(=O)=O)ccc(Oc2ccc(OC(=S)N(C)C)cc2)cc1
SPLASH	splash10-00di-9000000000-624e6e68566d6942bb71
Source of Spectrum	Y-34-1266-8
Wiley ID	1318183