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(3Z)-3-Hexenyl pentanoate
SpectraBase Compound ID EyMi5AeICeB
InChI InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h5,7H,3-4,6,8-10H2,1-2H3/b7-5-
InChIKey XPFTVTFOOTVHIA-ALCCZGGFSA-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 B2nNnHscwcK
Name (3Z-Hexenyl) valerate
CAS Registry Number 35852-46-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h5,7H,3-4,6,8-10H2,1-2H3/b7-5-
InChIKey XPFTVTFOOTVHIA-ALCCZGGFSA-N
Molecular Weight 184.279 g/mol
SMILES C(COC(CCCC)=O)\C=C/CC
SPLASH splash10-05o0-9000000000-611437810d3adc80bb16
Source ex BEDOUKIAN ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Hexenyl valerate<3Z->
Wiley ID 1887502