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N,N'-(4-METHYL-1,3-PHENYLENE)BIS[3-AMINO-2-(2-
SpectraBase Compound ID DA4N2K5DQJm
InChI InChI=1S/C27H20N4O4/c1-17-10-11-20(28-13-18(15-32)26-30-21-6-2-4-8-24(21)34-26)12-23(17)29-14-19(16-33)27-31-22-7-3-5-9-25(22)35-27/h2-16,28-29H,1H3/b18-13+,19-14+
InChIKey SIFYPWGAWZGTMF-JIBZRZDWSA-N
Mol Weight 464.48 g/mol
Molecular Formula C27H20N4O4
Exact Mass 464.148455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkEouD5x47J
Name N,N'-(4-METHYL-1,3-PHENYLENE)BIS[3-AMINO-2-(2-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H20N4O4
InChI InChI=1S/C27H20N4O4/c1-17-10-11-20(28-13-18(15-32)26-30-21-6-2-4-8-24(21)34-26)12-23(17)29-14-19(16-33)27-31-22-7-3-5-9-25(22)35-27/h2-16,28-29H,1H3/b18-13+,19-14+
InChIKey SIFYPWGAWZGTMF-JIBZRZDWSA-N
Molecular Weight 464.1480
SMILES N(c1cc(N\C=C\(c2oc3ccccc3n2)C=O)c(cc1)C)\C=C/(C=O)c1oc2ccccc2n1
SPLASH splash10-0296-9420000000-8b2fad5a764a19858708
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany