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1-Hexen-3-ol
SpectraBase Compound ID 8P8EmvdbqAW
InChI InChI=1S/C6H12O/c1-3-5-6(7)4-2/h4,6-7H,2-3,5H2,1H3
InChIKey BVOSSZSHBZQJOI-UHFFFAOYSA-N
Mol Weight 100.16 g/mol
Molecular Formula C6H12O
Exact Mass 100.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZxARHzaGJd
Name Hexen-3-ol
Source of Sample SAFC Cat.no. W360805
CAS Registry Number 4798-44-1
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 100.088815005 u
Formula C6H12O
InChI InChI=1S/C6H12O/c1-3-5-6(7)4-2/h4,6-7H,2-3,5H2,1H3
InChIKey BVOSSZSHBZQJOI-UHFFFAOYSA-N
Molecular Weight 100.161 g/mol
Number of Peaks 50
RI1 778
RI2 440
RI3 659
RI4 616
SMILES OC(C=C)CCC
SPLASH splash10-0a4i-9000000000-9eaa5679ea538dfb24c5
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 1-Hexen-3-ol
Wiley ID LM_FFNSC3_541