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3-((Epoxymethyl)phenyl)-2-methyl-1-oxodihydroisoquinoline
SpectraBase Compound ID E32TwdQplzs
InChI InChI=1S/C17H13NO3/c1-18-14(8-11-4-2-3-5-13(11)17(18)19)12-6-7-15-16(9-12)21-10-20-15/h2-9H,10H2,1H3
InChIKey XDOPDEMNYLWUEB-UHFFFAOYSA-N
Mol Weight 279.29 g/mol
Molecular Formula C17H13NO3
Exact Mass 279.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9IMkprdw3A
Name 3-((Epoxymethyl)phenyl)-2-methyl-1-oxodihydroisoquinoline
Alternate Name(s) 2-Methyl-3-(3,4-methylenedioxyphenyl)-1(2H)-isoquinolone 3-(1,3-benzodioxol-5-yl)-2-methyl-1(2H)-isoquinolinone
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Formula C17H13NO3
InChI InChI=1S/C17H13NO3/c1-18-14(8-11-4-2-3-5-13(11)17(18)19)12-6-7-15-16(9-12)21-10-20-15/h2-9H,10H2,1H3
InChIKey XDOPDEMNYLWUEB-UHFFFAOYSA-N
Molecular Weight 279.295 g/mol
SMILES C=1(N(C(c2c(C1)cccc2)=O)C)c1cc2OCOc2cc1
SPLASH splash10-004i-0090000000-470b1facffa304b37e7f
Source of Spectrum KC-0-475-1
Wiley ID 787329