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3,5-Bis(trifluoromethyl)benzoic acid
SpectraBase Compound ID L7vFDraa7pr
InChI InChI=1S/C9H4F6O2/c10-8(11,12)5-1-4(7(16)17)2-6(3-5)9(13,14)15/h1-3H,(H,16,17)
InChIKey HVFQJWGYVXKLTE-UHFFFAOYSA-N
Mol Weight 258.12 g/mol
Molecular Formula C9H4F6O2
Exact Mass 258.011548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AN8LbhCvlcZ
Name BENZOIC ACID, 3,5-BIS(TRIFLUOROMETHYL)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H4F6O2
InChI InChI=1S/C9H4F6O2/c10-8(11,12)5-1-4(7(16)17)2-6(3-5)9(13,14)15/h1-3H,(H,16,17)
InChIKey HVFQJWGYVXKLTE-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 258.0114
SMILES OC(=O)c1cc(C(F)(F)F)cc(c1)C(F)(F)F
SPLASH splash10-01ox-2290000000-360937617c37427d9c64
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany