For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzamide, N-(4-cyano-5-methyl-2-oxo-3-trifluoromethyl-2,3-dihydro-1H-pyrrol-3-yl)-3-fluoro-
SpectraBase Compound ID Xed8f6mz7w
InChI InChI=1S/C14H9F4N3O2/c1-7-10(6-19)13(12(23)20-7,14(16,17)18)21-11(22)8-3-2-4-9(15)5-8/h2-5H,1H3,(H,20,23)(H,21,22)
InChIKey PTMDFVFAEADJPV-UHFFFAOYSA-N
Mol Weight 327.24 g/mol
Molecular Formula C14H9F4N3O2
Exact Mass 327.063089 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Bs30oIsT8OX
Name Benzamide, N-(4-cyano-5-methyl-2-oxo-3-trifluoromethyl-2,3-dihydro-1H-pyrrol-3-yl)-3-fluoro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9F4N3O2
InChI InChI=1S/C14H9F4N3O2/c1-7-10(6-19)13(12(23)20-7,14(16,17)18)21-11(22)8-3-2-4-9(15)5-8/h2-5H,1H3,(H,20,23)(H,21,22)
InChIKey PTMDFVFAEADJPV-UHFFFAOYSA-N
Molecular Weight 327.239 g/mol
SMILES N1C(=C(C(C1=O)(NC(=O)c1cc(ccc1)F)C(F)(F)F)C#N)C
SPLASH splash10-00di-7901000000-1a45a8bbf8da542be922
Synonyms N-[4-cyano-2-keto-5-methyl-3-(trifluoromethyl)-2-pyrrolin-3-yl]-3-fluoro-benzamide N-[4-cyano-5-methyl-2-oxidanylidene-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-fluoranyl-benzamide N-[4-cyano-5-methyl-2-oxo-3-(trifluoromethyl)-1H-pyrrol-3-yl]-3-fluoro-benzamide
Wiley ID 1438581