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N-{{2-[2-(diethylamino)ethylamino}-6-methyl-4-pyrimidinyl}anthranilic acid, dihydrochloride, monohydrate
SpectraBase Compound ID AZH5EAW32pc
InChI InChI=1S/C18H25N5O2.2ClH.H2O/c1-4-23(5-2)11-10-19-18-20-13(3)12-16(22-18)21-15-9-7-6-8-14(15)17(24)25;;;/h6-9,12H,4-5,10-11H2,1-3H3,(H,24,25)(H2,19,20,21,22);2*1H;1H2
InChIKey NLLIAUOBBCCKMM-UHFFFAOYSA-N
Mol Weight 434.37 g/mol
Molecular Formula C18H29Cl2N5O3
Exact Mass 433.164745 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LYMt4rGOEih
Name N-{2-{[2-(DIETHYLAMINO)ETHYL]AMINO}-6-METHYL-4-PYRIMIDINYL}ANTHRANILIC ACID, DIHYDROCHLORIDE, MONOHYDRATE
Source of Sample E. Falch, Pharmacia As, Copenhagen, Denmark
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29Cl2N5O3
InChI InChI=1S/C18H25N5O2.2ClH.H2O/c1-4-23(5-2)11-10-19-18-20-13(3)12-16(22-18)21-15-9-7-6-8-14(15)17(24)25;;;/h6-9,12H,4-5,10-11H2,1-3H3,(H,24,25)(H2,19,20,21,22);2*1H;1H2
InChIKey NLLIAUOBBCCKMM-UHFFFAOYSA-N
Literature Reference JMCH 11, 608(1968)
Melting Point 229-230C (dec.)
Molecular Weight 434.362000
Synonyms BENZOIC ACID, O-///2-/2-/DIETHYL- AMINO/ETHYL/AMINO/-6-METHYL-4- PYRIMIDINYL/AMINO/-, DIHYDROCHLORIDE, MONOHYDRATE ANTHRANILIC ACID, N-//2-/2-/DI- ETHYLAMINO/ETHYL/AMINO/-6-METHYL-4- PYRIMIDINYL/-, DIHYDROCHLORIDE, MONO- HYDRATE
Technique KBr WAFER