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Elemenone<cis-beta->
SpectraBase Compound ID GbY97MPgX0T
InChI InChI=1S/C15H22O/c1-7-15(6)9-14(16)12(10(2)3)8-13(15)11(4)5/h7,13H,1,4,8-9H2,2-3,5-6H3/t13-,15-/m0/s1
InChIKey ABLPGPHZENVRRH-ZFWWWQNUSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QRhHXU3F6q
Name Elemenone
CAS Registry Number 30824-86-3
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 218.167065327 u
Formula C15H22O
InChI InChI=1S/C15H22O/c1-7-15(6)9-14(16)12(10(2)3)8-13(15)11(4)5/h7,13H,1,4,8-9H2,2-3,5-6H3/t13-,15-/m0/s1
InChIKey ABLPGPHZENVRRH-ZFWWWQNUSA-N
Molecular Weight 218.340 g/mol
Number of Peaks 50
RI1 1600
SMILES [C@@]1(CC(C(C[C@]1(C(=C)C)[H])=C(C)C)=O)(C)C=C
SPLASH splash10-059l-7900000000-ca2d6fccac78801912ac
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 Cyclohexanone, 5-ethenyl-5-methyl-4-(1-methylethenyl)-2-(1-methylethylidene)-
Wiley ID LM_FFNSC3_2808