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2-tert-pentylcyclohexanol, acetate
SpectraBase Compound ID ImxFY9yqhw9
InChI InChI=1S/C13H24O2/c1-5-13(3,4)11-8-6-7-9-12(11)15-10(2)14/h11-12H,5-9H2,1-4H3
InChIKey YEVACTAGDANHRH-UHFFFAOYSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPZWNDPu850
Name Coniferan
CAS Registry Number 67874-72-0
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 212.177630011 u
Formula C13H24O2
InChI InChI=1S/C13H24O2/c1-5-13(3,4)11-8-6-7-9-12(11)15-10(2)14/h11-12H,5-9H2,1-4H3
InChIKey YEVACTAGDANHRH-UHFFFAOYSA-N
Molecular Weight 212.333 g/mol
Number of Peaks 50
RI1 1401
RI2 1080
RI3 1090
RI4 1048
SMILES C1CCC(C(C1)C(CC)(C)C)OC(C)=O
SPLASH splash10-00ec-9100000000-7fbec0f1c735e9eb49fc
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 Cyclohexanol, 2-(1,1-dimethylpropyl)-, acetate
Wiley ID LM_FFNSC3_1303