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2-Methoxy-5-(3',4'-methylenedioxyphenyl)cyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID KCHZaazSYF5
InChI InChI=1S/C15H12O4/c1-17-13-6-3-10(2-5-12(13)16)11-4-7-14-15(8-11)19-9-18-14/h2-8H,9H2,1H3
InChIKey POISPALLWBHUJN-UHFFFAOYSA-N
Mol Weight 256.26 g/mol
Molecular Formula C15H12O4
Exact Mass 256.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BmgxwUi0eR
Name 2-Methoxy-5-(3',4'-methylenedioxyphenyl)cyclohepta-2,4,6-trien-1-one
Alternate Name(s) 5-(1,3-benzodioxol-5-yl)-2-methoxy-2,4,6-cycloheptatrien-1-one 5-(1,3-benzodioxol-5-yl)-2-methoxy-1-cyclohepta-2,4,6-trienone 5-(1,3-benzodioxol-5-yl)-2-methoxycyclohepta-2,4,6-trien-1-one
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Formula C15H12O4
InChI InChI=1S/C15H12O4/c1-17-13-6-3-10(2-5-12(13)16)11-4-7-14-15(8-11)19-9-18-14/h2-8H,9H2,1H3
InChIKey POISPALLWBHUJN-UHFFFAOYSA-N
Molecular Weight 256.257 g/mol
SMILES C1(=CC=C(OC)C(C=C1)=O)c1cc2c(OCO2)cc1
SPLASH splash10-0a6r-0090000000-12bce4a1059a99dfe8e0
Source of Spectrum B-44-705-0
Wiley ID 1259836