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6-Chloro-1-methyl-4-nitroindoline-2,3-dione

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

6-Chloro-1-methyl-4-nitroindoline-2,3-dione
SpectraBase Compound ID sWLT2EKiW
InChI InChI=1S/C9H5ClN2O4/c1-11-5-2-4(10)3-6(12(15)16)7(5)8(13)9(11)14/h2-3H,1H3
InChIKey DCYRHAVVIIAXIW-UHFFFAOYSA-N
Mol Weight 240.6 g/mol
Molecular Formula C9H5ClN2O4
Exact Mass 239.993784 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LeDphxluhsJ
Name 6-Chloro-1-methyl-4-nitroindoline-2,3-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.993784345 u
Formula C9H5ClN2O4
InChI InChI=1S/C9H5ClN2O4/c1-11-5-2-4(10)3-6(12(15)16)7(5)8(13)9(11)14/h2-3H,1H3
InChIKey DCYRHAVVIIAXIW-UHFFFAOYSA-N
Molecular Weight 240.602 g/mol
SMILES C=1(Cl)C=C(C2=C(C1)N(C(C2=O)=O)C)[N+](=O)[O-]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.836415