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3-Trifluoromethylbenzoic acid, 3-chloroprop-2-enyl ester
SpectraBase Compound ID 5NY2xcwGkhN
InChI InChI=1S/C11H8ClF3O2/c12-5-2-6-17-10(16)8-3-1-4-9(7-8)11(13,14)15/h1-5,7H,6H2/b5-2+
InChIKey PUYCTCTXIMUWRA-GORDUTHDSA-N
Mol Weight 264.63 g/mol
Molecular Formula C11H8ClF3O2
Exact Mass 264.016492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8G2wEMbBa9H
Name 3-Trifluoromethylbenzoic acid, 3-chloroprop-2-enyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8ClF3O2
InChI InChI=1S/C11H8ClF3O2/c12-5-2-6-17-10(16)8-3-1-4-9(7-8)11(13,14)15/h1-5,7H,6H2/b5-2+
InChIKey PUYCTCTXIMUWRA-GORDUTHDSA-N
Molecular Weight 264.631 g/mol
SMILES c1(cccc(c1)C(=O)OC\C=C\Cl)C(F)(F)F
SPLASH splash10-00di-2910000000-b9f8a89af8e9f88029ec
Source of Spectrum NP-7-9121-0
Synonyms 3-(trifluoromethyl)benzoic acid [(E)-3-chloroprop-2-enyl] ester [(E)-3-chloroprop-2-enyl] 3-(trifluoromethyl)benzoate [(E)-3-chloroallyl] 3-(trifluoromethyl)benzoate [(E)-3-chloranylprop-2-enyl] 3-(trifluoromethyl)benzoate
Wiley ID 1106917