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6-Hydroxy-6-[4-(trifluoromethyl)phenyl]hexanal
SpectraBase Compound ID 4gwdwovcPro
InChI InChI=1S/C13H15F3O2/c14-13(15,16)11-7-5-10(6-8-11)12(18)4-2-1-3-9-17/h5-9,12,18H,1-4H2
InChIKey LXJCLNCNINROAD-UHFFFAOYSA-N
Mol Weight 260.26 g/mol
Molecular Formula C13H15F3O2
Exact Mass 260.102414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEJokYhlMup
Name 6-Hydroxy-6-[4-(trifluoromethyl)phenyl]hexanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15F3O2
InChI InChI=1S/C13H15F3O2/c14-13(15,16)11-7-5-10(6-8-11)12(18)4-2-1-3-9-17/h5-9,12,18H,1-4H2
InChIKey LXJCLNCNINROAD-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201302261
Molecular Weight 260.256 g/mol
SMILES OC(c1ccc(C(F)(F)F)cc1)CCCCC=O
SPLASH splash10-004i-5920000000-840e7ef83c558c3559e8
Source of Spectrum ACI-52-SMS-10-S15
Synonyms 6-Hydroxy-6-(4-(trifluoromethyl)phenyl)hexanal
Wiley ID 1781480