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1,9,9b-Triazaphenalene-3-carboxylic acid, ethyl ester
SpectraBase Compound ID LNBKahTivdm
InChI InChI=1S/C13H11N3O2/c1-2-18-12(17)10-8-15-13-14-7-6-9-4-3-5-11(10)16(9)13/h3-8H,2H2,1H3
InChIKey YPWWEBPDSXNFJS-UHFFFAOYSA-N
Mol Weight 241.25 g/mol
Molecular Formula C13H11N3O2
Exact Mass 241.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WfCT8owLo
Name 1,9,9b-Triazaphenalene-3-carboxylic acid, ethyl ester
CAS Registry Number 60246-91-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11N3O2
InChI InChI=1S/C13H11N3O2/c1-2-18-12(17)10-8-15-13-14-7-6-9-4-3-5-11(10)16(9)13/h3-8H,2H2,1H3
InChIKey YPWWEBPDSXNFJS-UHFFFAOYSA-N
Molecular Weight 241.250 g/mol
SMILES C12=C(C=NC=3N2C(C=CN3)=CC=C1)C(=O)OCC
SPLASH splash10-03dl-0590000000-8b71b845fb57b86e5712
Source of Spectrum SB-30-467-0
Synonyms 3-Carboxy-1,9-diazacycl(3.3.3)azine Ethyl 1,9,9b-triazaphenalene-3-carboxylate
Wiley ID 1244047