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9H-Pyrido[3,4-b]indole-3-carboxylic acid, 1-(2-phenylethenyl)-, methyl ester
SpectraBase Compound ID C1U4S0SyONB
InChI InChI=1S/C21H16N2O2/c1-25-21(24)19-13-16-15-9-5-6-10-17(15)23-20(16)18(22-19)12-11-14-7-3-2-4-8-14/h2-13,23H,1H3/b12-11+
InChIKey GHXIPMLOSPYZGK-VAWYXSNFSA-N
Mol Weight 328.37 g/mol
Molecular Formula C21H16N2O2
Exact Mass 328.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7pyzE9kNtT
Name 9H-Pyrido[3,4-b]indole-3-carboxylic acid, 1-(2-phenylethenyl)-, methyl ester
CAS Registry Number 74914-76-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O2
InChI InChI=1S/C21H16N2O2/c1-25-21(24)19-13-16-15-9-5-6-10-17(15)23-20(16)18(22-19)12-11-14-7-3-2-4-8-14/h2-13,23H,1H3/b12-11+
InChIKey GHXIPMLOSPYZGK-VAWYXSNFSA-N
Molecular Weight 328.371 g/mol
SMILES [nH]1c2c(c3c1c(nc(c3)C(=O)OC)\C=C\c1ccccc1)cccc2
SPLASH splash10-014i-0094000000-8fe3378b67e5ac0dc948
Source of Spectrum Y-17-596-0
Synonyms 3-Methoxycarbonyl-1-stryryl-.beta.-carbolin Methyl 1-[(E)-2-phenylethenyl]-9H-.beta.-carboline-3-carboxylate
Wiley ID 1326629