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(4R,1'R,2'R)-4-(2'-Trifluoroacetylamido-1'-phenylpropoxy)hex-1-ene
SpectraBase Compound ID Jkm2tCgX1AL
InChI InChI=1S/C17H22F3NO2/c1-4-9-14(5-2)23-15(13-10-7-6-8-11-13)12(3)21-16(22)17(18,19)20/h4,6-8,10-12,14-15H,1,5,9H2,2-3H3,(H,21,22)/t12-,14-,15+/m1/s1
InChIKey PQJKWIONBRIRKK-YUELXQCFSA-N
Mol Weight 329.36 g/mol
Molecular Formula C17H22F3NO2
Exact Mass 329.160263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VhzoJcEyxU
Name (4R,1'R,2'R)-4-(2'-Trifluoroacetylamido-1'-phenylpropoxy)hex-1-ene
Alternate Name(s) N-((1R,2R)-2-{[(1R)-1-ethyl-3-butenyl]oxy}-1-methyl-2-phenylethyl)-2,2,2-trifluoroacetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22F3NO2
InChI InChI=1S/C17H22F3NO2/c1-4-9-14(5-2)23-15(13-10-7-6-8-11-13)12(3)21-16(22)17(18,19)20/h4,6-8,10-12,14-15H,1,5,9H2,2-3H3,(H,21,22)/t12-,14-,15+/m1/s1
InChIKey PQJKWIONBRIRKK-YUELXQCFSA-N
Molecular Weight 329.363 g/mol
SMILES N(C(C(F)(F)F)=O)[C@@]([C@](O[C@@](CC=C)(CC)[H])(c1ccccc1)[H])(C)[H]
SPLASH splash10-053r-3920000000-c26ff782f436c9fe13ed
Source of Spectrum QE-2-1168-4
Wiley ID 842742