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cis-3-Hexenyl tiglate
SpectraBase Compound ID C2236cXRdjn
InChI InChI=1S/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5+
InChIKey JNWQKXUWZWKUAY-JQEGGOPCSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JuzkxrNHs5m
Name (3Z)-Hexenyl tiglate
Alternate Name(s) Hexenyl tiglate<3Z->
CAS Registry Number 67883-79-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
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/C11H18O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5-7H,4,8-9H2,1-3H3/b7-6-,10-5+
InChIKey JNWQKXUWZWKUAY-JQEGGOPCSA-N
Molecular Weight 182.263 g/mol
SMILES C(\C=C/CC)COC(\C(=C\C)C)=O
SPLASH splash10-001i-9000000000-a6c1473eb484dba74a22
Source ex BEDOUKAIN CHEM ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886433