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2-Methoxy-5-phenylcyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID J9kwRbZQjxV
InChI InChI=1S/C14H12O2/c1-16-14-10-8-12(7-9-13(14)15)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey YHJWJHIQFSYAKI-UHFFFAOYSA-N
Mol Weight 212.25 g/mol
Molecular Formula C14H12O2
Exact Mass 212.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9EodxvmY9hE
Name 2-Methoxy-5-phenylcyclohepta-2,4,6-trien-1-one
Alternate Name(s) 2-methoxy-5-phenyl-1-cyclohepta-2,4,6-trienone 2-methoxy-5-phenyl-2,4,6-cycloheptatrien-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C14H12O2
InChI InChI=1S/C14H12O2/c1-16-14-10-8-12(7-9-13(14)15)11-5-3-2-4-6-11/h2-10H,1H3
InChIKey YHJWJHIQFSYAKI-UHFFFAOYSA-N
Molecular Weight 212.248 g/mol
SMILES C1(=CC=C(OC)C(C=C1)=O)c1ccccc1
SPLASH splash10-03di-0290000000-deb104bb1f3cfc20a62b
Source of Spectrum B-44-705-0
Wiley ID 1211968