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1-Octanol, 2-butyl-
SpectraBase Compound ID 3bvnJtefIcy
InChI InChI=1S/C12H26O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h12-13H,3-11H2,1-2H3
InChIKey XMVBHZBLHNOQON-UHFFFAOYSA-N
Mol Weight 186.34 g/mol
Molecular Formula C12H26O
Exact Mass 186.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NKob5hUCIN
Name 1-Octanol, 2-butyl-
CAS Registry Number 3913-02-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H26O
InChI InChI=1S/C12H26O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h12-13H,3-11H2,1-2H3
InChIKey XMVBHZBLHNOQON-UHFFFAOYSA-N
Molecular Weight 186.339 g/mol
SMILES OCC(CCCCCC)CCCC
SPLASH splash10-0a4l-9000000000-379221a0aa2f9f0c14bd
Source of Spectrum NP-3-3451-0
Synonyms 2-Butyl-1-octanol 2-Butyloctan-1-ol 2-Butyloctanol 2-Butyloctyl alcohol 5-(Hydroxymethyl)undecane Butyloctanol Isododecyl alcohol AI3-19958 BRN 1738522 EINECS 223-470-0 MICHEL XO-150-12 NSC 2414
Wiley ID 1102604