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2-Trifluoromethylbenzoic acid, ethyl ester
SpectraBase Compound ID G27GCi2T40G
InChI InChI=1S/C10H9F3O2/c1-2-15-9(14)7-5-3-4-6-8(7)10(11,12)13/h3-6H,2H2,1H3
InChIKey BQLMZZVRHPZRBQ-UHFFFAOYSA-N
Mol Weight 218.18 g/mol
Molecular Formula C10H9F3O2
Exact Mass 218.055464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5TU4Ds11Wj0
Name 2-Trifluoromethylbenzoic acid, ethyl ester
Alternate Name(s) Ethyl 2-(trifluoromethyl)benzoate
CAS Registry Number 577-62-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9F3O2
InChI InChI=1S/C10H9F3O2/c1-2-15-9(14)7-5-3-4-6-8(7)10(11,12)13/h3-6H,2H2,1H3
InChIKey BQLMZZVRHPZRBQ-UHFFFAOYSA-N
Molecular Weight 218.175 g/mol
SMILES C(c1c(C(=O)OCC)cccc1)(F)(F)F
SPLASH splash10-00dj-1900000000-58a9572c4ff51461d233
Source of Spectrum F4-46-S8-3y
Wiley ID 1742168