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3,4,5-trifluoro-N-phenylbenzamide
SpectraBase Compound ID 7vGJdxxStrt
InChI InChI=1S/C13H8F3NO/c14-10-6-8(7-11(15)12(10)16)13(18)17-9-4-2-1-3-5-9/h1-7H,(H,17,18)
InChIKey UIKLONDAPIJPGH-UHFFFAOYSA-N
Mol Weight 251.21 g/mol
Molecular Formula C13H8F3NO
Exact Mass 251.055798 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KiiVRLlDd8A
Name 3,4,5-trifluoro-N-phenylbenzamide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.055798370 u
Formula C13H8F3NO
InChI InChI=1S/C13H8F3NO/c14-10-6-8(7-11(15)12(10)16)13(18)17-9-4-2-1-3-5-9/h1-7H,(H,17,18)
InChIKey UIKLONDAPIJPGH-UHFFFAOYSA-N
Instrument Name GCMS-QP2010 Ultra
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.2c02197
Molecular Weight 251.208 g/mol
Quality 17
SMILES N(C(C=1C=C(C(=C(C1)F)F)F)=O)C1=CC=CC=C1
SPLASH splash10-0a4i-0900000000-2d0a9a9a4b462166bf69
Source of Spectrum JOC-88-SM13-2a (DOI: 10.1021/acs.joc.2c02197)
Wiley ID 1912617