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3-(Diethylamino)-2,3-dioxo-1-phenylpropyl N,N'-diphenylimidothiocarbamate

View entire compound with spectra: 2 MS (GC)

3-(Diethylamino)-2,3-dioxo-1-phenylpropyl N,N'-diphenylimidothiocarbamate
SpectraBase Compound ID BpEYu31pMxG
InChI InChI=1S/C26H27N3O2S/c1-3-29(4-2)25(31)23(30)24(20-14-8-5-9-15-20)32-26(27-21-16-10-6-11-17-21)28-22-18-12-7-13-19-22/h5-19,24H,3-4H2,1-2H3,(H,27,28)
InChIKey KVAHJXYMBKRQHL-UHFFFAOYSA-N
Mol Weight 445.58 g/mol
Molecular Formula C26H27N3O2S
Exact Mass 445.182398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HaFv9YU5UIW
Name N,N-DIETHYL-3-(N,N'-DIPHENYLAMIDINOTHIO)-3-PHENYLPYRUVAMIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H27N3O2S
InChI InChI=1S/C26H27N3O2S/c1-3-29(4-2)25(31)23(30)24(20-14-8-5-9-15-20)32-26(27-21-16-10-6-11-17-21)28-22-18-12-7-13-19-22/h5-19,24H,3-4H2,1-2H3,(H,27,28)
InChIKey KVAHJXYMBKRQHL-UHFFFAOYSA-N
Molecular Weight 445.1818
SMILES N(c1ccccc1)\C(=N/c1ccccc1)SC(C(C(N(CC)CC)=O)=O)c1ccccc1
SPLASH splash10-0uml-9300000000-4f80f1def56a449b0345
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany