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2,6-Dimethyl-4-heptanol, acetate
SpectraBase Compound ID IVHTKyyO6KP
InChI InChI=1S/C11H22O2/c1-8(2)6-11(7-9(3)4)13-10(5)12/h8-9,11H,6-7H2,1-5H3
InChIKey XLJDNKNPKUBQMX-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1M3bTZb9qO2
Name Alicate
Source of Sample Standard L'Oreal
CAS Registry Number 10250-45-0
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 186.161979946 u
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-8(2)6-11(7-9(3)4)13-10(5)12/h8-9,11H,6-7H2,1-5H3
InChIKey XLJDNKNPKUBQMX-UHFFFAOYSA-N
Molecular Weight 186.295 g/mol
Number of Peaks 50
RI1 1095
RI2 770
SMILES C(C)(=O)OC(CC(C)C)CC(C)C
SPLASH splash10-0006-9000000000-566352aadce7cc03d4b1
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 4-Heptanol, 2,6-dimethyl-, 4-acetate
Wiley ID LM_FFNSC3_3074