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Hexadienol propanoate<2E,4E->
SpectraBase Compound ID dPXVfwEOra
InChI InChI=1S/C9H14O2/c1-3-5-6-7-8-11-9(10)4-2/h3,5-7H,4,8H2,1-2H3/b5-3+,7-6+
InChIKey ZVBREIRNEOXCKQ-TWTPFVCWSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9q5QdVIdyFv
Name (2E,4E)-Hexadienol propanoate
CAS Registry Number 95994-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
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/C9H14O2/c1-3-5-6-7-8-11-9(10)4-2/h3,5-7H,4,8H2,1-2H3/b5-3+,7-6+
InChIKey ZVBREIRNEOXCKQ-TWTPFVCWSA-N
Molecular Weight 154.209 g/mol
SMILES C(C(OC\C=C\C=C\C)=O)C
SPLASH splash10-0a4i-9000000000-fda820bb351b2808ee5e
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Hexadienol propanoate<2E,4E->
Wiley ID 1886413