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Benzenepentanol, .beta.-chloro-3-(trifluoromethyl)-
SpectraBase Compound ID ITtXqZ212RQ
InChI InChI=1S/C12H14ClF3O/c13-11(8-17)6-2-4-9-3-1-5-10(7-9)12(14,15)16/h1,3,5,7,11,17H,2,4,6,8H2
InChIKey XZLJASZTARTCSE-UHFFFAOYSA-N
Mol Weight 266.69 g/mol
Molecular Formula C12H14ClF3O
Exact Mass 266.068527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DEbwo3pxA4p
Name Benzenepentanol, .beta.-chloro-3-(trifluoromethyl)-
Alternate Name(s) 2-Chloro-5-[3-(trifluoromethyl)phenyl]-1-pentanol
CAS Registry Number 114423-34-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14ClF3O
InChI InChI=1S/C12H14ClF3O/c13-11(8-17)6-2-4-9-3-1-5-10(7-9)12(14,15)16/h1,3,5,7,11,17H,2,4,6,8H2
InChIKey XZLJASZTARTCSE-UHFFFAOYSA-N
Molecular Weight 266.691 g/mol
SMILES OCC(Cl)CCCc1cc(C(F)(F)F)ccc1
SPLASH splash10-0ab9-0900000000-42a10c056663fc607d56
Source of Spectrum J-53-3312-12
Wiley ID 1269556