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p-Phenylenebis[1,1',3,3'-tetramethyl-2,2'-di(p-nitrophenyl)pyrimidiniumolate]
SpectraBase Compound ID 5ZTD3K8bsjU
InChI InChI=1S/C30H24N6O8/c1-31-25(19-9-13-21(14-10-19)35(41)42)32(2)28(38)23(27(31)37)17-5-7-18(8-6-17)24-29(39)33(3)26(34(4)30(24)40)20-11-15-22(16-12-20)36(43)44/h5-16H,1-4H3
InChIKey REQOTUKXBLYZRY-UHFFFAOYSA-N
Mol Weight 596.56 g/mol
Molecular Formula C30H24N6O8
Exact Mass 596.165562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LRb9IK0F5q
Name p-Phenylenebis[1,1',3,3'-tetramethyl-2,2'-di(p-nitrophenyl)pyrimidiniumolate]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H24N6O8
InChI InChI=1S/C30H24N6O8/c1-31-25(19-9-13-21(14-10-19)35(41)42)32(2)28(38)23(27(31)37)17-5-7-18(8-6-17)24-29(39)33(3)26(34(4)30(24)40)20-11-15-22(16-12-20)36(43)44/h5-16H,1-4H3
InChIKey REQOTUKXBLYZRY-UHFFFAOYSA-N
Molecular Weight 596.556 g/mol
SMILES C=1([N+](=C(N(C(C1c1ccc(C2=C([N+](C)=C(N(C2=O)C)c2ccc(N(=O)=O)cc2)[O-])cc1)=O)C)c1ccc(N(=O)=O)cc1)C)[O-]
SPLASH splash10-01pp-0900000000-2e7bb47ba1e1f0ee9250
Source of Spectrum F-52-5483-8
Wiley ID 796298