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ACETIAMINE

View entire compound with spectra: 2 MS (GC)

ACETIAMINE
SpectraBase Compound ID 9VN4zynz71C
InChI InChI=1S/C16H22N4O4S/c1-10(15(25-13(4)23)5-6-24-12(3)22)20(9-21)8-14-7-18-11(2)19-16(14)17/h7,9H,5-6,8H2,1-4H3,(H2,17,18,19)/b15-10-
InChIKey ISIPQAHMLLFSFR-GDNBJRDFSA-N
Mol Weight 366.44 g/mol
Molecular Formula C16H22N4O4S
Exact Mass 366.136176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GxSrruKa1F
Name ACETIAMINE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H22N4O4S
InChI InChI=1S/C16H22N4O4S/c1-10(15(25-13(4)23)5-6-24-12(3)22)20(9-21)8-14-7-18-11(2)19-16(14)17/h7,9H,5-6,8H2,1-4H3,(H2,17,18,19)/b15-10-
InChIKey ISIPQAHMLLFSFR-GDNBJRDFSA-N
Instrument Name DI
Molecular Weight 366.436 g/mol
SMILES C\C(=C/(CCOC(C)=O)SC(C)=O)N(C=O)Cc1c(N)nc(C)nc1
SPLASH splash10-00dl-9700000000-6bb6baaf2d0093ca6c86
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany