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4-Trifluoromethylbenzamide

View entire compound with spectra: 7 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

4-Trifluoromethylbenzamide
SpectraBase Compound ID IYRMvlh27kN
InChI InChI=1S/C8H6F3NO/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H2,12,13)
InChIKey WEJHBEDHLLBJFW-UHFFFAOYSA-N
Mol Weight 189.14 g/mol
Molecular Formula C8H6F3NO
Exact Mass 189.040148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FB3972E0l7w
Name 4-Trifluoromethylbenzamide
Alternate Name(s) p-Trifluoromethylbenzamide N-(4-Trifluoromethyl)benzamide 4-(Trifluoromethyl)benzamide Benzamide, 4-(trifluoromethyl)- 4-CF3-C6H4CONH2
CAS Registry Number 1891-90-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6F3NO
InChI InChI=1S/C8H6F3NO/c9-8(10,11)6-3-1-5(2-4-6)7(12)13/h1-4H,(H2,12,13)
InChIKey WEJHBEDHLLBJFW-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4cc01054j
Molecular Weight 189.137 g/mol
SMILES NC(c1ccc(cc1)C(F)(F)F)=O
SPLASH splash10-00ds-0900000000-e099d6f4f65e2e9c4997
Source of Spectrum KD-50-4747/SM-arb5
Wiley ID 1754536