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3-Hexen-1-ol, propanoate, (Z)-
SpectraBase Compound ID BDW0e6N39WZ
InChI InChI=1S/C9H16O2/c1-3-5-6-7-8-11-9(10)4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5-
InChIKey LGTLDEUQCOJGFP-WAYWQWQTSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67Qtv6uWvzH
Name Hex-(3Z)-enol propanoate
Source of Sample SAFC Cat.no. W393304
CAS Registry Number 33467-74-2
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 156.115029753 u
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-3-5-6-7-8-11-9(10)4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5-
InChIKey LGTLDEUQCOJGFP-WAYWQWQTSA-N
Molecular Weight 156.225 g/mol
Number of Peaks 50
RI1 1101
RI2 776
SMILES C(CC)(=O)OCC\C=C/CC
SPLASH splash10-067i-9000000000-0eb5d961f29852410d25
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 3-Hexen-1-ol, propanoate, (3Z)-
Wiley ID LM_FFNSC3_784