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2,6-Bis-(6-methyl-4-phenyl-1,4-dihydro-pyrimidin-2-ylamino)pyrrolo[3,4-f]isoindole-1,3,5,7-tetraone
SpectraBase Compound ID IlEwNlSiWZQ
InChI InChI=1S/C32H26N8O4/c1-17-13-25(19-9-5-3-6-10-19)35-31(33-17)37-39-27(41)21-15-23-24(16-22(21)28(39)42)30(44)40(29(23)43)38-32-34-18(2)14-26(36-32)20-11-7-4-8-12-20/h3-16,25-26H,1-2H3,(H2,33,35,37)(H2,34,36,38)
InChIKey QZSICLBIOVCSBK-UHFFFAOYSA-N
Mol Weight 586.6 g/mol
Molecular Formula C32H26N8O4
Exact Mass 586.207701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EKd1kv1NCu
Name 2,6-Bis-(6-methyl-4-phenyl-1,4-dihydro-pyrimidin-2-ylamino)pyrrolo[3,4-f]isoindole-1,3,5,7-tetraone
Alternate Name(s) 2,6-bis[(6-methyl-4-phenyl-1,4-dihydropyrimidin-2-yl)amino]pyrrolo[3,4-f]isoindole-1,3,5,7-tetrone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H26N8O4
InChI InChI=1S/C32H26N8O4/c1-17-13-25(19-9-5-3-6-10-19)35-31(33-17)37-39-27(41)21-15-23-24(16-22(21)28(39)42)30(44)40(29(23)43)38-32-34-18(2)14-26(36-32)20-11-7-4-8-12-20/h3-16,25-26H,1-2H3,(H2,33,35,37)(H2,34,36,38)
InChIKey QZSICLBIOVCSBK-UHFFFAOYSA-N
Molecular Weight 586.612 g/mol
SMILES N(C1=NC(c2ccccc2)C=C(N1)C)N1C(c2cc3C(N(C(c3cc2C1=O)=O)NC1=NC(c2ccccc2)C=C(N1)C)=O)=O
SPLASH splash10-001j-5493010000-0053b2d7ffba4ab74583
Source of Spectrum F2-44-4791-16
Wiley ID 1705876