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1,9-Bis-benzylamino-5-methyl-5H-dipyrido[4,3-b;3',4'-d]pyrrole-3,7-dicarboxylic acid diethyl ester
SpectraBase Compound ID C4gnAN8Pv9Q
InChI InChI=1S/C31H31N5O4/c1-4-39-30(37)22-16-24-26(28(34-22)32-18-20-12-8-6-9-13-20)27-25(36(24)3)17-23(31(38)40-5-2)35-29(27)33-19-21-14-10-7-11-15-21/h6-17H,4-5,18-19H2,1-3H3,(H,32,34)(H,33,35)
InChIKey DWPOUCLPTWNUQF-UHFFFAOYSA-N
Mol Weight 537.62 g/mol
Molecular Formula C31H31N5O4
Exact Mass 537.237604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiL6lGqpSxJ
Name 1,9-Bis-benzylamino-5-methyl-5H-dipyrido[4,3-b;3',4'-d]pyrrole-3,7-dicarboxylic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H31N5O4
InChI InChI=1S/C31H31N5O4/c1-4-39-30(37)22-16-24-26(28(34-22)32-18-20-12-8-6-9-13-20)27-25(36(24)3)17-23(31(38)40-5-2)35-29(27)33-19-21-14-10-7-11-15-21/h6-17H,4-5,18-19H2,1-3H3,(H,32,34)(H,33,35)
InChIKey DWPOUCLPTWNUQF-UHFFFAOYSA-N
Molecular Weight 537.620 g/mol
SMILES N(c1nc(cc2c1c1c(nc(cc1[n]2C)C(=O)OCC)NCc1ccccc1)C(=O)OCC)Cc1ccccc1
SPLASH splash10-0006-9020100000-ce2c87dd593f84f48223
Source of Spectrum F-51-12139-11a
Wiley ID 794129