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2,4,6-Cycloheptatrien-1-one, 2,3-dimethyl-
SpectraBase Compound ID 6XPsTQ0BMMt
InChI InChI=1S/C9H10O/c1-7-5-3-4-6-9(10)8(7)2/h3-6H,1-2H3
InChIKey NIYPIHTXGIMBAT-UHFFFAOYSA-N
Mol Weight 134.18 g/mol
Molecular Formula C9H10O
Exact Mass 134.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHDDG3FE059
Name 2,4,6-Cycloheptatrien-1-one, 2,3-dimethyl-
Alternate Name(s) 2,3-Dimethyl-2,4,6-cycloheptatrien-1-one 2,3-Dimethyl-1-cyclohepta-2,4,6-trienone 2,3-Dimethylcyclohepta-2,4,6-trien-1-one
CAS Registry Number 53951-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O
InChI InChI=1S/C9H10O/c1-7-5-3-4-6-9(10)8(7)2/h3-6H,1-2H3
InChIKey NIYPIHTXGIMBAT-UHFFFAOYSA-N
Molecular Weight 134.178 g/mol
SMILES CC=1C=CC=CC(C1C)=O
SPLASH splash10-0006-9200000000-f46184260a23e890b8a1
Source of Spectrum DC-0-18-4
Wiley ID 6383