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1H-Indole-2,3-dione, 7-chloro-5-methyl-

View entire compound with spectra: 1 FTIR

1H-Indole-2,3-dione, 7-chloro-5-methyl-
SpectraBase Compound ID K9wE5wepN6y
InChI InChI=1S/C9H6ClNO2/c1-4-2-5-7(6(10)3-4)11-9(13)8(5)12/h2-3H,1H3,(H,11,12,13)
InChIKey ADICIMUACYTZNW-UHFFFAOYSA-N
Mol Weight 195.6 g/mol
Molecular Formula C9H6ClNO2
Exact Mass 195.008706 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID J06OVilbXNR
Name 1H-Indole-2,3-dione, 7-chloro-5-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 195.008706135 u
Formula C9H6ClNO2
InChI InChI=1S/C9H6ClNO2/c1-4-2-5-7(6(10)3-4)11-9(13)8(5)12/h2-3H,1H3,(H,11,12,13)
InChIKey ADICIMUACYTZNW-UHFFFAOYSA-N
Molecular Weight 195.605 g/mol
SMILES C12=C(C=C(C=C2Cl)C)C(=O)C(N1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.9382