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13,13-Dimethyl-7-oxo-7,13-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylic acid
SpectraBase Compound ID GlgNCXESFT9
InChI InChI=1S/C20H17NO3/c1-20(2)10-16-13-7-5-8-14(19(23)24)17(13)18(22)21(16)11-12-6-3-4-9-15(12)20/h3-10H,11H2,1-2H3,(H,23,24)
InChIKey IJSUMMCUJZHQPL-UHFFFAOYSA-N
Mol Weight 319.36 g/mol
Molecular Formula C20H17NO3
Exact Mass 319.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHRA69KpqtY
Name 13,13-Dimethyl-7-oxo-7,13-dihydro-5H-isoindolo[2,1-b][2]benzazepine-8-carboxylic acid
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Formula C20H17NO3
InChI InChI=1S/C20H17NO3/c1-20(2)10-16-13-7-5-8-14(19(23)24)17(13)18(22)21(16)11-12-6-3-4-9-15(12)20/h3-10H,11H2,1-2H3,(H,23,24)
InChIKey IJSUMMCUJZHQPL-UHFFFAOYSA-N
Molecular Weight 319.360 g/mol
SMILES OC(=O)c1c2c(ccc1)C=1N(Cc3c(cccc3)C(C)(C)C1)C2=O
SPLASH splash10-0udi-6944000000-ed4b248713f8e693d88e
Synonyms 6,6-Dimethyl-12-oxo-6,12-dihydro-11H-11a-aza-dibenzo[a,f]azulene-1-carboxylic acid
Wiley ID 1511038