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exo-5-Cyano-6-hydroxy-3a,4,5,6-tetrahydro-1H,3H-1-azaphenalen-2-one
SpectraBase Compound ID 2AXlmLIkkIZ
InChI InChI=1S/C13H12N2O2/c14-6-8-4-7-5-11(16)15-10-3-1-2-9(12(7)10)13(8)17/h1-3,7-8,13,17H,4-5H2,(H,15,16)
InChIKey ZBJVOAOBGSAAAD-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0XxuqtH38v
Name exo-5-Cyano-6-hydroxy-3a,4,5,6-tetrahydro-1H,3H-1-azaphenalen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c14-6-8-4-7-5-11(16)15-10-3-1-2-9(12(7)10)13(8)17/h1-3,7-8,13,17H,4-5H2,(H,15,16)
InChIKey ZBJVOAOBGSAAAD-UHFFFAOYSA-N
Molecular Weight 228.251 g/mol
SMILES N1c2cccc3c2C(CC(C3O)C#N)CC1=O
SPLASH splash10-0fb9-0930000000-3e3cf306c9782bca4329
Source of Spectrum QF-10-2186-10
Synonyms endo-5-Cyano-6-hydroxy-3a,4,5,6-tetrahydro-1H,3H-1-azaphenalen-2-one 6-Hydroxy-2-oxo-2,3,3a,4,5,6-hexahydro-1H-benzo[de]quinoline-5-carbonitrile
Wiley ID 1559457