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2-(4-Methylphenyl)-5,6-bis(4-methoxyphenyl)pyridazino[3,4-d][3,1]oxazin-4-one

View entire compound with spectra: 1 MS (GC)

2-(4-Methylphenyl)-5,6-bis(4-methoxyphenyl)pyridazino[3,4-d][3,1]oxazin-4-one
SpectraBase Compound ID 4s7ji8ZYrG7
InChI InChI=1S/C27H21N3O4/c1-16-4-6-19(7-5-16)26-28-25-23(27(31)34-26)22(17-8-12-20(32-2)13-9-17)24(29-30-25)18-10-14-21(33-3)15-11-18/h4-15H,1-3H3
InChIKey LTPFPDKESWSLST-UHFFFAOYSA-N
Mol Weight 451.48 g/mol
Molecular Formula C27H21N3O4
Exact Mass 451.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cAjzWIvqCg
Name 2-(4-Methylphenyl)-5,6-bis(4-methoxyphenyl)pyridazino[3,4-d][3,1]oxazin-4-one
Alternate Name(s) 3,4-Bis-(4-methoxy-phenyl)-7-p-tolyl-pyridazino[3,4-d][1,3]oxazin-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H21N3O4
InChI InChI=1S/C27H21N3O4/c1-16-4-6-19(7-5-16)26-28-25-23(27(31)34-26)22(17-8-12-20(32-2)13-9-17)24(29-30-25)18-10-14-21(33-3)15-11-18/h4-15H,1-3H3
InChIKey LTPFPDKESWSLST-UHFFFAOYSA-N
Molecular Weight 451.482 g/mol
SMILES c12N=C(OC(c2c(-c2ccc(cc2)OC)c(nn1)-c1ccc(cc1)OC)=O)c1ccc(cc1)C
SPLASH splash10-014i-0900300000-5cc59e03f0d14e73d22b
Source of Spectrum F-49-592-16
Wiley ID 1387997