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(2E,4S)-2,4-Dimethylhex-2-en-1-ol
SpectraBase Compound ID 9rO3YUjkyq0
InChI InChI=1S/C8H16O/c1-4-7(2)5-8(3)6-9/h5,7,9H,4,6H2,1-3H3/b8-5+/t7-/m1/s1
InChIKey WPJVSAFPWVVPTB-KBUNYLKBSA-N
Mol Weight 128.21 g/mol
Molecular Formula C8H16O
Exact Mass 128.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ht3Ul002myF
Name (2E,4S)-2,4-Dimethylhex-2-en-1-ol
Appearance Colourless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H16O
InChI InChI=1S/C8H16O/c1-4-7(2)5-8(3)6-9/h5,7,9H,4,6H2,1-3H3/b8-5+/t7-/m1/s1
InChIKey WPJVSAFPWVVPTB-KBUNYLKBSA-N
Instrument Name Agilent 7890A/Agilent 5975C
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.14.9
Molecular Weight 128.215 g/mol
SMILES OC\C(=C\[C@](C)(CC)[H])C
SPLASH splash10-052o-9000000000-daaa3a9c78b5d1607de7
Source of Spectrum BJO-14-SM13-26
Thin-Layer Chromatography Rf = 0.31 (hexane/ethyl acetate, 5:1)
Wiley ID 1843520