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Cyclopentyl 3-(trifluoromethyl)benzoate
SpectraBase Compound ID eLgpGF2JLv
InChI InChI=1S/C13H13F3O2/c14-13(15,16)10-5-3-4-9(8-10)12(17)18-11-6-1-2-7-11/h3-5,8,11H,1-2,6-7H2
InChIKey IGZNNYBVWUTYDU-UHFFFAOYSA-N
Mol Weight 258.24 g/mol
Molecular Formula C13H13F3O2
Exact Mass 258.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I6JMJbM5kZY
Name Cyclopentyl 3-(trifluoromethyl)benzoate
Alternate Name(s) 3-Trifluoromethylbenzoic acid, cyclopentyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13F3O2
InChI InChI=1S/C13H13F3O2/c14-13(15,16)10-5-3-4-9(8-10)12(17)18-11-6-1-2-7-11/h3-5,8,11H,1-2,6-7H2
InChIKey IGZNNYBVWUTYDU-UHFFFAOYSA-N
Molecular Weight 258.240 g/mol
SMILES C1C(CCC1)OC(=O)c1cccc(C(F)(F)F)c1
SPLASH splash10-00di-1900000000-631eead3d8f008c50634
Source of Spectrum NP-7-5829-0
Wiley ID 1106611