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anti-1-Phenyl-4-[4-(trifluoromethyl)phenyl]-1,4-butanediol
SpectraBase Compound ID Kyx2gt9tSZl
InChI InChI=1S/C17H17F3O2/c18-17(19,20)14-8-6-13(7-9-14)16(22)11-10-15(21)12-4-2-1-3-5-12/h1-9,15-16,21-22H,10-11H2
InChIKey UIVQLPBXLFVOMV-UHFFFAOYSA-N
Mol Weight 310.32 g/mol
Molecular Formula C17H17F3O2
Exact Mass 310.118064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6eooivNhukg
Name anti-1-Phenyl-4-[4-(trifluoromethyl)phenyl]-1,4-butanediol
Alternate Name(s) 1-Phenyl-4-[4-(trifluoromethyl)phenyl]-1,4-butanediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17F3O2
InChI InChI=1S/C17H17F3O2/c18-17(19,20)14-8-6-13(7-9-14)16(22)11-10-15(21)12-4-2-1-3-5-12/h1-9,15-16,21-22H,10-11H2
InChIKey UIVQLPBXLFVOMV-UHFFFAOYSA-N
Molecular Weight 310.316 g/mol
SMILES OC(CCC(O)c1ccccc1)c1ccc(cc1)C(F)(F)F
SPLASH splash10-03di-0191000000-b7eae1354496dd2a186a
Source of Spectrum QF-9-5264-6
Wiley ID 1558973