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p-{{2,4-diamino-6-{4-{[ethyl(2-hydroxyethyl)amino]butyl}amino}pyrimidin-5-yl}azo}benzoic acid, ethyl ester
SpectraBase Compound ID 9BEeVYoIBNR
InChI InChI=1S/C21H32N8O3/c1-3-29(13-14-30)12-6-5-11-24-19-17(18(22)25-21(23)26-19)28-27-16-9-7-15(8-10-16)20(31)32-4-2/h7-10,30H,3-6,11-14H2,1-2H3,(H5,22,23,24,25,26)/b28-27+
InChIKey LPHIFWFYOAGWAF-BYYHNAKLSA-N
Mol Weight 444.5 g/mol
Molecular Formula C21H32N8O3
Exact Mass 444.259737 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID FprsdgW6utS
Name p-{{2,4-DIAMINO-6-{4-{[ETHYL(2-HYDROXYETHYL)AMINO]BUTYL}AMINO}PYRIMIDIN-5-YL}AZO}BENZOIC ACID, ETHYL ESTER
Source of Sample D. J. Triggle, State University of New York At Buffalo, Amherst, New York
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32N8O3
InChI InChI=1S/C21H32N8O3/c1-3-29(13-14-30)12-6-5-11-24-19-17(18(22)25-21(23)26-19)28-27-16-9-7-15(8-10-16)20(31)32-4-2/h7-10,30H,3-6,11-14H2,1-2H3,(H5,22,23,24,25,26)/b28-27+
InChIKey LPHIFWFYOAGWAF-BYYHNAKLSA-N
Melting Point 168C
Molecular Weight 444.540009
Synonyms BENZOIC ACID, P-//2,4-DIAMINO-6- /4-//ETHYL/2-HYDROXYETHYL/AMINO/BUTYL/- AMINO/PYRIMIDIN-5-YL/AZO/-, ETHYL ESTER
Technique KBr WAFER