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1-Phenyl-3-(trifluoromethyl)butane-1,4-diol
SpectraBase Compound ID 6ryrGANzd27
InChI InChI=1S/C11H13F3O2/c12-11(13,14)9(7-15)6-10(16)8-4-2-1-3-5-8/h1-5,9-10,15-16H,6-7H2
InChIKey GTIVVGKGHNIFLK-UHFFFAOYSA-N
Mol Weight 234.22 g/mol
Molecular Formula C11H13F3O2
Exact Mass 234.086764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDI6GXeb0hi
Name 1-Phenyl-3-(trifluoromethyl)butane-1,4-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13F3O2
InChI InChI=1S/C11H13F3O2/c12-11(13,14)9(7-15)6-10(16)8-4-2-1-3-5-8/h1-5,9-10,15-16H,6-7H2
InChIKey GTIVVGKGHNIFLK-UHFFFAOYSA-N
Literature Reference DOI 10.1002/asia.201201130
Molecular Weight 234.218 g/mol
SMILES OCC(CC(O)c1ccccc1)C(F)(F)F
SPLASH splash10-056r-9400000000-45f70418acb3c2bedbdb
Source of Spectrum CAJ-8-556/SM13-11
Wiley ID 1771934