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Carbamimidothioic acid, N-[2-(dimethylamino)-1,1-dimethyl-2-oxoethyl]-N'-phenyl-, methyl ester
SpectraBase Compound ID 9ibRIeCdhUk
InChI InChI=1S/C14H21N3OS/c1-14(2,12(18)17(3)4)16-13(19-5)15-11-9-7-6-8-10-11/h6-10H,1-5H3,(H,15,16)
InChIKey NDLHFKFEEMKRNN-UHFFFAOYSA-N
Mol Weight 279.4 g/mol
Molecular Formula C14H21N3OS
Exact Mass 279.140533 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6z36tGeJIn5
Name Carbamimidothioic acid, N-[2-(dimethylamino)-1,1-dimethyl-2-oxoethyl]-N'-phenyl-, methyl ester
CAS Registry Number 70169-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21N3OS
InChI InChI=1S/C14H21N3OS/c1-14(2,12(18)17(3)4)16-13(19-5)15-11-9-7-6-8-10-11/h6-10H,1-5H3,(H,15,16)
InChIKey NDLHFKFEEMKRNN-UHFFFAOYSA-N
Molecular Weight 279.402 g/mol
SMILES N(\C(=N/C(C(N(C)C)=O)(C)C)SC)c1ccccc1
SPLASH splash10-0a4i-0920000000-fe921db3f3e2b9dca039
Source of Spectrum H-62-168-0
Synonyms 1-(1'-Dimethylcarbamoyl-1'-methylethyl)-2-methyl-3-phenylisothiourea Methyl N'-[(E)-2-(dimethylamino)-1,1-dimethyl-2-oxoethyl]-N-phenylimidothiocarbamate
Wiley ID 1282898