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5,9b-Diazabenz[cd]azulene-4-carboxylic acid, ethyl ester
SpectraBase Compound ID 4u9ULyiN9zf
InChI InChI=1S/C14H12N2O2/c1-2-18-14(17)12-9-11-8-7-10-5-3-4-6-13(15-12)16(10)11/h3-9H,2H2,1H3
InChIKey CHKNFNJBAHOKOY-UHFFFAOYSA-N
Mol Weight 240.26 g/mol
Molecular Formula C14H12N2O2
Exact Mass 240.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fxa7pZ0Dqgq
Name 5,9b-Diazabenz[cd]azulene-4-carboxylic acid, ethyl ester
CAS Registry Number 72649-13-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N2O2
InChI InChI=1S/C14H12N2O2/c1-2-18-14(17)12-9-11-8-7-10-5-3-4-6-13(15-12)16(10)11/h3-9H,2H2,1H3
InChIKey CHKNFNJBAHOKOY-UHFFFAOYSA-N
Molecular Weight 240.262 g/mol
SMILES C1=2[n]3c(ccc3C=CC=C1)C=C(N2)C(=O)OCC
SPLASH splash10-00kf-0980000000-de1fe8facc0c7f7a5dba
Source of Spectrum K-112-3586-0
Synonyms Ethyl 5,9b-diazabenzo[cd]azulene-4-carboxylate Ethyl ester of 5,9b-diazabenz(cd)azulen-4-carboxylic acid
Wiley ID 1243013