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1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-amino-2-(2-pyridinyl)-
SpectraBase Compound ID GDv5FzyECAL
InChI InChI=1S/C17H11N3O2/c18-13-8-7-12-15-10(13)4-3-5-11(15)16(21)20(17(12)22)14-6-1-2-9-19-14/h1-9H,18H2
InChIKey STYATCDNTDDHNI-UHFFFAOYSA-N
Mol Weight 289.29 g/mol
Molecular Formula C17H11N3O2
Exact Mass 289.085127 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6OXI3ZgPFi4
Name 1H-Benz[de]isoquinoline-1,3(2H)-dione, 6-amino-2-(2-pyridinyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.085126604 u
Formula C17H11N3O2
InChI InChI=1S/C17H11N3O2/c18-13-8-7-12-15-10(13)4-3-5-11(15)16(21)20(17(12)22)14-6-1-2-9-19-14/h1-9H,18H2
InChIKey STYATCDNTDDHNI-UHFFFAOYSA-N
SMILES C1=CC=C2C3=C1C(N)=CC=C3C(N(C2=O)C=1C=CC=CN1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.865197