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(2E)-Hexenyl isovalerate
SpectraBase Compound ID HiWja3AP4BJ
InChI InChI=1S/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h6-7,10H,4-5,8-9H2,1-3H3/b7-6+
InChIKey SAVRWHQEMHIAEB-VOTSOKGWSA-N
Mol Weight 184.28 g/mol
Molecular Formula C11H20O2
Exact Mass 184.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KpZGJB5kMei
Name Hexenyl isovalerate<2E->
CAS Registry Number 68698-59-9
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 184.146329882 u
Formula C11H20O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h6-7,10H,4-5,8-9H2,1-3H3/b7-6+
InChIKey SAVRWHQEMHIAEB-VOTSOKGWSA-N
Molecular Weight 184.279 g/mol
Nominal Mass 184 u
Number of Peaks 105
SMILES C(CC(C)C)(=O)OC\C=C\CCC
SPLASH splash10-0a4u-9000000000-0d411ce58a6df264f9b0
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001734