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(2S)-(+)-1,2-OCTANEDIOL
SpectraBase Compound ID C3s04cQ8Oan
InChI InChI=1S/C8H18O2/c1-2-3-4-5-6-8(10)7-9/h8-10H,2-7H2,1H3
InChIKey AEIJTFQOBWATKX-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 KgEU4L9qZLd
Name 1,2-Octanediol
CAS Registry Number 1117-86-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18O2
InChI InChI=1S/C8H18O2/c1-2-3-4-5-6-8(10)7-9/h8-10H,2-7H2,1H3
InChIKey AEIJTFQOBWATKX-UHFFFAOYSA-N
Molecular Weight 146.230 g/mol
SMILES OC(CO)CCCCCC
SPLASH splash10-0a4j-9000000000-1dd8a6e0adb0e6603fd0
Source of Spectrum AA-0-844-2
Synonyms 1,2-Dihydroxyoctane 1,2-Octylene glycol Octane-1,2-diol AI3-13058 EINECS 214-254-7 NSC 71546
Wiley ID 9188