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3,7-Dimethyl-1-octanol
SpectraBase Compound ID ExFfTDwHJFR
InChI InChI=1S/C10H22O/c1-9(2)5-4-6-10(3)7-8-11/h9-11H,4-8H2,1-3H3
InChIKey PRNCMAKCNVRZFX-UHFFFAOYSA-N
Mol Weight 158.28 g/mol
Molecular Formula C10H22O
Exact Mass 158.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LaSgp8tY4s
Name Pelargol
Source of Sample SAFC Cat.no. W239100
CAS Registry Number 106-21-8
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 158.167065327 u
Formula C10H22O
InChI InChI=1S/C10H22O/c1-9(2)5-4-6-10(3)7-8-11/h9-11H,4-8H2,1-3H3
InChIKey PRNCMAKCNVRZFX-UHFFFAOYSA-N
Molecular Weight 158.285 g/mol
Number of Peaks 50
RI1 1200
RI2 878
RI3 1068
RI4 1025
SMILES OCCC(CCCC(C)C)C
SPLASH splash10-0a4l-9000000000-30c73c78cca579b221d2
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-Octanol, 3,7-dimethyl-
Wiley ID LM_FFNSC3_329