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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 FcILGiSki5P
Name 1,8-Octanediol
CAS Registry Number 629-41-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
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
SMILES OCCCCCCCCO
SPLASH splash10-067l-9000000000-62a5c17503e162fa13f7
Source ex PFATZ ex JJ BROPHY
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Octanediol<1,8->
Wiley ID 1887728