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S-Ethyl (E)-(acetylamino)(phenylimino)methylthiocarbamate

View entire compound with spectra: 2 MS (GC)

S-Ethyl (E)-(acetylamino)(phenylimino)methylthiocarbamate
SpectraBase Compound ID 4HuiLM8ToZ4
InChI InChI=1S/C12H15N3O2S/c1-3-18-12(17)15-11(13-9(2)16)14-10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H2,13,14,15,16,17)
InChIKey YKBCRTKPQFGRCK-UHFFFAOYSA-N
Mol Weight 265.33 g/mol
Molecular Formula C12H15N3O2S
Exact Mass 265.088498 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1y3thy32g28
Name CARBAMOTHIOIC ACID, [(ACETYLAMINO)(PHENYLAMINO)METHYLENE]-, S-ETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H15N3O2S
InChI InChI=1S/C12H15N3O2S/c1-3-18-12(17)15-11(13-9(2)16)14-10-7-5-4-6-8-10/h4-8H,3H2,1-2H3,(H2,13,14,15,16,17)
InChIKey YKBCRTKPQFGRCK-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 265.0882
SMILES N(\C(=N/C(C)=O)Nc1ccccc1)C(=O)SCC
SPLASH splash10-01r6-9310000000-45cfd11efa53b7b5b982
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany