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2,3,6,7-TETRAHYDRO-8-METHOXY-4-(4-NITROPHENYL)-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE
SpectraBase Compound ID 1a3Cm6bCjWo
InChI InChI=1S/C20H17N5O4/c1-29-20-23-18-17(19(26)24-20)21-15(13-7-9-14(10-8-13)25(27)28)11-16(22-18)12-5-3-2-4-6-12/h2-10,16H,11H2,1H3,(H2,22,23,24,26)
InChIKey FGYQVLHXVKAVJJ-UHFFFAOYSA-N
Mol Weight 391.39 g/mol
Molecular Formula C20H17N5O4
Exact Mass 391.128054 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GCRFO1Ip5hi
Name 2,3,6,7-Tetrahydro-8-methoxy-4-(4'-nitrophenyl)-2-phenyl-1H-pyrimodo[4,5-b]-[1,4]-diazepin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N5O4
InChI InChI=1S/C20H17N5O4/c1-29-20-23-18-17(19(26)24-20)21-15(13-7-9-14(10-8-13)25(27)28)11-16(22-18)12-5-3-2-4-6-12/h2-10,16H,11H2,1H3,(H2,22,23,24,26)
InChIKey FGYQVLHXVKAVJJ-UHFFFAOYSA-N
Molecular Weight 391.387 g/mol
SMILES N1C(=NC2=C(N=C(CC(N2)c2ccccc2)c2ccc(N(=O)=O)cc2)C1=O)OC
SPLASH splash10-0006-0339000000-89293beabfe3a78ba717
Source of Spectrum Y-31-63-3
Wiley ID 761451