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Germacrone
SpectraBase Compound ID 6n9lcjYzNQp
InChI InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3/b12-8+,13-7+
InChIKey CAULGCQHVOVVRN-SWZPTJTJSA-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 BwZcixQx1s0
Name Germacrone
Source of Sample SAFC Cat.no. W276618
CAS Registry Number 6902-91-6
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 218.167065327 u
Formula C15H22O
InChI InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3/b12-8+,13-7+
InChIKey CAULGCQHVOVVRN-SWZPTJTJSA-N
Molecular Weight 218.340 g/mol
Number of Peaks 50
RI1 1698
RI2 1375
SMILES C1C\C(=C\CC(C(C\C(=C\1)C)=O)=C(C)C)C
SPLASH splash10-0a4u-7900000000-f5ce53a3f0e9c2fa0a1b
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-Cyclodecadien-1-one, 3,7-dimethyl-10-(1-methylethylidene)-, (3E,7E)-
Wiley ID LM_FFNSC3_1658