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9-Amino-2-chloro-6H-benzo[c]chromene-8,10-dicarbonitrile

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

9-Amino-2-chloro-6H-benzo[c]chromene-8,10-dicarbonitrile
SpectraBase Compound ID 6yOaDpHxdPG
InChI InChI=1S/C15H8ClN3O/c16-10-1-2-13-11(4-10)14-9(7-20-13)3-8(5-17)15(19)12(14)6-18/h1-4H,7,19H2
InChIKey ZPDSAOLCDGTPLT-UHFFFAOYSA-N
Mol Weight 281.7 g/mol
Molecular Formula C15H8ClN3O
Exact Mass 281.03559 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2vU6b9bzBbd
Name 9-Amino-2-chloro-6H-benzo[C]chromene-8,10-dicarbonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.035589589 u
Formula C15H8ClN3O
InChI InChI=1S/C15H8ClN3O/c16-10-1-2-13-11(4-10)14-9(7-20-13)3-8(5-17)15(19)12(14)6-18/h1-4H,7,19H2
InChIKey ZPDSAOLCDGTPLT-UHFFFAOYSA-N
SMILES C1(=C2C3=C(C=CC(=C3)Cl)OCC2=CC(=C1N)C#N)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.849659