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Methyl 4-hydroxy-1-(4-methylphenyl)-11-oxo-11H-pyridazino[4,5-c][1]benzazepine-5-carboxylate
SpectraBase Compound ID 4QRTlNHxPNe
InChI InChI=1S/C21H15N3O4/c1-11-7-9-12(10-8-11)17-15-16(20(26)24-23-17)18(21(27)28-2)22-14-6-4-3-5-13(14)19(15)25/h3-10H,1-2H3,(H,24,26)
InChIKey BTPROFFCMORMHQ-UHFFFAOYSA-N
Mol Weight 373.37 g/mol
Molecular Formula C21H15N3O4
Exact Mass 373.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FDRuiYhBdos
Name Methyl 4-hydroxy-1-(4-methylphenyl)-11-oxo-11H-pyridazino[4,5-c][1]benzazepine-5-carboxylate
Appearance Yellow powder
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Formula C21H15N3O4
InChI InChI=1S/C21H15N3O4/c1-11-7-9-12(10-8-11)17-15-16(20(26)24-23-17)18(21(27)28-2)22-14-6-4-3-5-13(14)19(15)25/h3-10H,1-2H3,(H,24,26)
InChIKey BTPROFFCMORMHQ-UHFFFAOYSA-N
Instrument Name A FINNIGAN-MAT 8430
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4127
Molecular Weight 373.368 g/mol
SMILES Oc1c2c(C(c3c(cccc3)N=C2C(OC)=O)=O)c(nn1)-c1ccc(cc1)C
SPLASH splash10-001l-9006000000-bb61f4c63bd495702a2f
Source of Spectrum Y-57-4206-6f
Wiley ID 1859955