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

*Links on SpectraBase are not permalinks.
3-(Trifluoromethoxy)benzoic acid
SpectraBase Compound ID CUAuneeuZeu
InChI InChI=1S/C8H5F3O3/c9-8(10,11)14-6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)
InChIKey OKPFIWIMBJNFSE-UHFFFAOYSA-N
Mol Weight 206.12 g/mol
Molecular Formula C8H5F3O3
Exact Mass 206.019079 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 8GAUIr3rXw8
Name 3-(Trifluoromethoxy)benzoic acid
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 206.019078507 u
Formula C8H5F3O3
InChI InChI=1S/C8H5F3O3/c9-8(10,11)14-6-3-1-2-5(4-6)7(12)13/h1-4H,(H,12,13)
InChIKey OKPFIWIMBJNFSE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 206.120 g/mol
Nominal Mass 206 u
Quality 937
Retention Index 1210
SMILES OC(C=1C=C(OC(F)(F)F)C=CC1)=O
SPLASH splash10-03y0-9410000000-e029b2aab45841822a66
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-(trifluoromethoxy)benzoic acid
Technique GC/MS
Wiley ID DD2024_005408