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BETA-DAMASCON
SpectraBase Compound ID 1bdaBAhRa6y
InChI InChI=1S/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7H,6,8-9H2,1-4H3/b7-5+
InChIKey BGTBFNDXYDYBEY-FNORWQNLSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbDZXpwtHpE
Name (E)-.beta.-Damascone
Alternate Name(s) Damascone<(E)-.beta.->
CAS Registry Number 23726-91-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O
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/C13H20O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5,7H,6,8-9H2,1-4H3/b7-5+
InChIKey BGTBFNDXYDYBEY-FNORWQNLSA-N
Molecular Weight 192.302 g/mol
SMILES C1CCC(C(=C1C)C(\C=C\C)=O)(C)C
SPLASH splash10-0006-9600000000-390838276c11d73f48c1
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886209