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3-Hepten-1-ol, acetate
SpectraBase Compound ID DIfplsppFC3
InChI InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h5-6H,3-4,7-8H2,1-2H3/b6-5-
InChIKey AAYIYWGTGAUKQY-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 2iDCI5tUhpY
Name Hept-(3Z)-en-1-ol acetate
CAS Registry Number 1576-78-9
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 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/c1-3-4-5-6-7-8-11-9(2)10/h5-6H,3-4,7-8H2,1-2H3/b6-5-
InChIKey AAYIYWGTGAUKQY-WAYWQWQTSA-N
Molecular Weight 156.225 g/mol
Number of Peaks 50
RI1 1100
RI2 775
SMILES C(OC(C)=O)C\C=C/CCC
SPLASH splash10-0006-9000000000-3687bc16a67c819109b8
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-Hepten-1-ol, acetate, (3Z)-
Wiley ID LM_FFNSC3_1538