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Pyrido[1,2-a]benzimidazole-1,2-dicarboxylic acid, 1,2,3,5-tetrahydro-3-(4-nitrophenyl)-
SpectraBase Compound ID AOCyVL0X101
InChI InChI=1S/C19H15N3O6/c23-18(24)16-12(10-5-7-11(8-6-10)22(27)28)9-15-20-13-3-1-2-4-14(13)21(15)17(16)19(25)26/h1-9,12,16-17,20H,(H,23,24)(H,25,26)
InChIKey WTEDVBOYJHFFNM-UHFFFAOYSA-N
Mol Weight 381.34 g/mol
Molecular Formula C19H15N3O6
Exact Mass 381.096085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzOn8DkAdY4
Name Pyrido[1,2-a]benzimidazole-1,2-dicarboxylic acid, 1,2,3,5-tetrahydro-3-(4-nitrophenyl)-
CAS Registry Number 116539-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H15N3O6
InChI InChI=1S/C19H15N3O6/c23-18(24)16-12(10-5-7-11(8-6-10)22(27)28)9-15-20-13-3-1-2-4-14(13)21(15)17(16)19(25)26/h1-9,12,16-17,20H,(H,23,24)(H,25,26)
InChIKey WTEDVBOYJHFFNM-UHFFFAOYSA-N
Molecular Weight 381.344 g/mol
SMILES OC(C1C(C(=O)O)C(C=C2N1c1c(cccc1)N2)c1ccc(N(=O)=O)cc1)=O
SPLASH splash10-02t9-0090000000-ef40921df7d4612f070c
Source of Spectrum O-23-145-1
Synonyms 1,2-Dicarboxy-1,2-dihydro-3-(para-nitrophenyl)-3H-pyrido[1,2-a]benzimidazole 3-(4-nitrophenyl)-1,2,3,5-tetrahydropyrido[1,2-a]benzimidazole-1,2-dicarboxylic acid
Wiley ID 1360127