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(2S,3S)-2-ethyl-3-phenyl-pent-4-en-1-ol
SpectraBase Compound ID 21F1XjpC1J0
InChI InChI=1S/C13H18O/c1-3-11(10-14)13(4-2)12-8-6-5-7-9-12/h4-9,11,13-14H,2-3,10H2,1H3/t11-,13+/m1/s1
InChIKey JRJRIDCLEYXQGG-YPMHNXCESA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ZAxZK59yx
Name (2S,3S)-2-ethyl-3-phenyl-pent-4-en-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-3-11(10-14)13(4-2)12-8-6-5-7-9-12/h4-9,11,13-14H,2-3,10H2,1H3/t11-,13+/m1/s1
InChIKey JRJRIDCLEYXQGG-YPMHNXCESA-N
Ionization Type EI
Molecular Weight 190.286 g/mol
Optical Rotation [a]D25 = -87.1 (c = 0.76, CH2Cl2)
Reported Formula C13H18O
SMILES OC[C@@](CC)([C@](C=C)(c1ccccc1)[H])[H]
SPLASH splash10-014i-1900000000-ce28cf0f275aed91af4a
Sample Comments dr = 10:1, 96% ee
Source of Spectrum CN101974026B
Wiley ID 1849478