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1,8-Octanediol
SpectraBase Compound ID 5TaQQHpKWyW
InChI InChI=1S/C8H18O2/c9-7-5-3-1-2-4-6-8-10/h9-10H,1-8H2
InChIKey OEIJHBUUFURJLI-UHFFFAOYSA-N
Mol Weight 146.23 g/mol
Molecular Formula C8H18O2
Exact Mass 146.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A9eJvqlaiBz
Name Octane-1,8-diol
Source of Sample SAFC Cat.no. O3303
CAS Registry Number 629-41-4
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 146.130679818 u
Formula C8H18O2
InChI InChI=1S/C8H18O2/c9-7-5-3-1-2-4-6-8-10/h9-10H,1-8H2
InChIKey OEIJHBUUFURJLI-UHFFFAOYSA-N
Molecular Weight 146.230 g/mol
Number of Peaks 49
RI1 1346
RI2 1024
SMILES OCCCCCCCCO
SPLASH splash10-066u-9000000000-9e56ba4c3ff988ebb3b5
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 1,8-Octanediol
Wiley ID LM_FFNSC3_1889