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(Z)-.beta.-Damascenone
SpectraBase Compound ID Dn2fGu6IVD6
InChI InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5-
InChIKey POIARNZEYGURDG-ALCCZGGFSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 35wcLWCWX2H
Name (Z)-.beta.-Damascenone
Alternate Name(s) Damascenone<(Z)-.beta.->
CAS Registry Number 59739-63-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-8H,9H2,1-4H3/b7-5-
InChIKey POIARNZEYGURDG-ALCCZGGFSA-N
Molecular Weight 190.286 g/mol
SMILES C1C=CC(=C(C1(C)C)C(\C=C/C)=O)C
SPLASH splash10-01bc-9400000000-58431290d5a73bbbb0b7
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1887930