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5H-Pyrido[4,3-b]indole-3-carboxylic acid, 5-methyl-1-(phenylamino)-, ethyl ester
SpectraBase Compound ID CXVK5b8bja5
InChI InChI=1S/C21H19N3O2/c1-3-26-21(25)16-13-18-19(15-11-7-8-12-17(15)24(18)2)20(23-16)22-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3,(H,22,23)
InChIKey KOCWQLGRWGXCGK-UHFFFAOYSA-N
Mol Weight 345.4 g/mol
Molecular Formula C21H19N3O2
Exact Mass 345.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEhVapZWRr
Name 5H-Pyrido[4,3-b]indole-3-carboxylic acid, 5-methyl-1-(phenylamino)-, ethyl ester
CAS Registry Number 116884-99-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O2
InChI InChI=1S/C21H19N3O2/c1-3-26-21(25)16-13-18-19(15-11-7-8-12-17(15)24(18)2)20(23-16)22-14-9-5-4-6-10-14/h4-13H,3H2,1-2H3,(H,22,23)
InChIKey KOCWQLGRWGXCGK-UHFFFAOYSA-N
Molecular Weight 345.402 g/mol
SMILES N(c1c2c([n](C)c3c2cccc3)cc(n1)C(=O)OCC)c1ccccc1
SPLASH splash10-00dj-0097000000-11aadb6e30a5b78b5466
Source of Spectrum KC-1988-1821-11
Synonyms 3-Ethoxycarbonyl-5-methyl-1-phenylaminopyrido[4,3-b]indole Ethyl 1-anilino-5-methyl-5H-pyrido[4,3-b]indole-3-carboxylate
Wiley ID 1338757