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1,4-Diethylhexyl 3-(trifluoromethyl)benzoate
SpectraBase Compound ID DS842LkIsk3
InChI InChI=1S/C18H25F3O2/c1-4-13(5-2)10-11-16(6-3)23-17(22)14-8-7-9-15(12-14)18(19,20)21/h7-9,12-13,16H,4-6,10-11H2,1-3H3
InChIKey UWEIOVKWSJTBOS-UHFFFAOYSA-N
Mol Weight 330.39 g/mol
Molecular Formula C18H25F3O2
Exact Mass 330.180665 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EtYs6ZmG4Lg
Name 1,4-Diethylhexyl 3-(trifluoromethyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25F3O2
InChI InChI=1S/C18H25F3O2/c1-4-13(5-2)10-11-16(6-3)23-17(22)14-8-7-9-15(12-14)18(19,20)21/h7-9,12-13,16H,4-6,10-11H2,1-3H3
InChIKey UWEIOVKWSJTBOS-UHFFFAOYSA-N
Molecular Weight 330.391 g/mol
SMILES c1cc(C(OC(CC)CCC(CC)CC)=O)cc(c1)C(F)(F)F
SPLASH splash10-00di-1900000000-dce70ead872b89a16c84
Source of Spectrum NP-11-7458-0
Synonyms 3-Trifluoromethylbenzoic acid, 6-ethyl-3-octyl ester 3-(trifluoromethyl)benzoic acid 6-ethyloctan-3-yl ester 6-Ethyloctan-3-yl 3-(trifluoromethyl)benzoate
Wiley ID 1109834