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2,4-Dinitrophenoxazine

View entire compound with spectra: 1 FTIR, 1 Raman, and 2 UV-Vis

2,4-Dinitrophenoxazine
SpectraBase Compound ID Kaukc3SmukM
InChI InChI=1S/C12H7N3O5/c16-14(17)7-5-9-12(10(6-7)15(18)19)20-11-4-2-1-3-8(11)13-9/h1-6,13H
InChIKey WEJDKQPLDURQEI-UHFFFAOYSA-N
Mol Weight 273.2 g/mol
Molecular Formula C12H7N3O5
Exact Mass 273.03857 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 2xChB9gVX8k
Name 2,4-Dinitrophenoxazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 273.038570332 u
Formula C12H7N3O5
InChI InChI=1S/C12H7N3O5/c16-14(17)7-5-9-12(10(6-7)15(18)19)20-11-4-2-1-3-8(11)13-9/h1-6,13H
InChIKey WEJDKQPLDURQEI-UHFFFAOYSA-N
Molecular Weight 273.204 g/mol
SMILES N1C2=C(C(=CC(=C2)N(=O)=O)N(=O)=O)OC=2C=CC=CC12
Spectrum/Structure Validation Score (Raman) 0.794127