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3,5-Dimethyl-5-(methoxymethyl)cyclohepta-2,6-dien-1-one
SpectraBase Compound ID E1RFZGakt0H
InChI InChI=1S/C11H16O2/c1-9-6-10(12)4-5-11(2,7-9)8-13-3/h4-6H,7-8H2,1-3H3
InChIKey VAESGUKTMGUWFH-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxniHkib0Ux
Name 3,5-Dimethyl-5-(methoxymethyl)cyclohepta-2,6-dien-1-one
Alternate Name(s) 5-(methoxymethyl)-3,5-dimethyl-2,6-cycloheptadien-1-one
CAS Registry Number 80722-08-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-9-6-10(12)4-5-11(2,7-9)8-13-3/h4-6H,7-8H2,1-3H3
InChIKey VAESGUKTMGUWFH-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES C1(=CC(C=CC(C1)(COC)C)=O)C
SPLASH splash10-052r-1900000000-185d91ee937e6a4c2892
Source of Spectrum J-47-1391-0
Wiley ID 1176450