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cis-3-Hexenyl isobutyrate
SpectraBase Compound ID 7UmYc5MXLcX
InChI InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h5-6,9H,4,7-8H2,1-3H3/b6-5-
InChIKey OSMAJVWUIUORGC-WAYWQWQTSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AnM09MbiJV1
Name (3Z)-Hexenyl isobutanoate
Alternate Name(s) Hexenyl isobutanoate<3Z->
CAS Registry Number 41519-23-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
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/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h5-6,9H,4,7-8H2,1-3H3/b6-5-
InChIKey OSMAJVWUIUORGC-WAYWQWQTSA-N
Molecular Weight 170.252 g/mol
SMILES C(COC(C(C)C)=O)\C=C/CC
SPLASH splash10-00kf-9000000000-fdbbc71f23bc70e8c034
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887494