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2-(4-Methylphenyl)-3-(2-hydroxyphenyl)-4-carboxy-1-oxo-1,2-dihydroisoquinoline
SpectraBase Compound ID E04jWnCzzsK
InChI InChI=1S/C23H17NO4/c1-14-10-12-15(13-11-14)24-21(18-8-4-5-9-19(18)25)20(23(27)28)16-6-2-3-7-17(16)22(24)26/h2-13,25H,1H3,(H,27,28)
InChIKey UOERKNRQDJDEJR-UHFFFAOYSA-N
Mol Weight 371.39 g/mol
Molecular Formula C23H17NO4
Exact Mass 371.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ryHvwEcnKx
Name 2-(4-Methylphenyl)-3-(2-hydroxyphenyl)-4-carboxy-1-oxo-1,2-dihydroisoquinoline
Alternate Name(s) 3-(2-hydroxyphenyl)-2-(4-methylphenyl)-1-oxo-1,2-dihydro-4-isoquinolinecarboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C23H17NO4
InChI InChI=1S/C23H17NO4/c1-14-10-12-15(13-11-14)24-21(18-8-4-5-9-19(18)25)20(23(27)28)16-6-2-3-7-17(16)22(24)26/h2-13,25H,1H3,(H,27,28)
InChIKey UOERKNRQDJDEJR-UHFFFAOYSA-N
Molecular Weight 371.392 g/mol
SMILES OC(C=1c2c(C(N(C1c1c(cccc1)O)c1ccc(cc1)C)=O)cccc2)=O
SPLASH splash10-004i-0090000000-8d61b3728a36f7f491ac
Source of Spectrum SO-0-87-7
Wiley ID 1541168