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10-Isopropylidene-3,7-dimethyl-(Z,Z)-3,7-cyclodecadiene-1-one
SpectraBase Compound ID I7jNRziwUy
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-SVGXSMIJSA-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 FchLndoHGtn
Name Germacrone
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
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
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-SVGXSMIJSA-N
Molecular Weight 218.340 g/mol
Nominal Mass 218 u
Number of Peaks 165
SMILES C(C)(C)=C1C(=O)C\C(C)=C/CC\C(=C/C1)C
SPLASH splash10-052u-6900000000-60e2e0ec5fa50cb6533d
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA002183