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Humulol
SpectraBase Compound ID 1E5hNGyUvwH
InChI InChI=1S/C15H26O/c1-13-7-5-10-15(4,16)11-6-9-14(2,3)12-8-13/h6,8-9,16H,5,7,10-12H2,1-4H3/b9-6+,13-8-
InChIKey ZLMAVMBYWKVCLV-QYKINMCYSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkKMDK0cFDm
Name Humulol
Source of Sample SAFC Cat.no. W290106
CAS Registry Number 28446-26-6
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 222.198365456 u
Formula C15H26O
InChI InChI=1S/C15H26O/c1-13-7-5-10-15(4,16)11-6-9-14(2,3)12-8-13/h6,8-9,16H,5,7,10-12H2,1-4H3/b9-6+,13-8-
InChIKey ZLMAVMBYWKVCLV-QYKINMCYSA-N
Molecular Weight 222.372 g/mol
Number of Peaks 50
RI1 1604
RI2 1282
SMILES OC1(CCC\C(=C/CC(\C=C\C1)(C)C)C)C
SPLASH splash10-001i-9200000000-cbc78cd4097db39aef27
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 3,7-Cycloundecadien-1-ol, 1,5,5,8-tetramethyl-, (3E,7E)-
Wiley ID LM_FFNSC3_1071