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1-Hepten-3-ol
SpectraBase Compound ID 3ldlzHC7ChR
InChI InChI=1S/C7H14O/c1-3-5-6-7(8)4-2/h4,7-8H,2-3,5-6H2,1H3
InChIKey PZKFYTOLVRCMOA-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BxV9SHAh5F
Name Hepten-3-ol
Source of Sample SAFC Cat.no. W412901
CAS Registry Number 4938-52-7
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 114.104465070 u
Formula C7H14O
InChI InChI=1S/C7H14O/c1-3-5-6-7(8)4-2/h4,7-8H,2-3,5-6H2,1H3
InChIKey PZKFYTOLVRCMOA-UHFFFAOYSA-N
Molecular Weight 114.188 g/mol
Number of Peaks 50
RI1 881
RI2 477
RI3 755
RI4 710
RI5 866
SMILES OC(C=C)CCCC
SPLASH splash10-0a4i-9000000000-b31e9004b0d07cee0ead
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-Hepten-3-ol
Wiley ID LM_FFNSC3_220