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4-Nitrobenzene-1,3-diol, diacetate

View entire compound with spectra: 1 FTIR

4-Nitrobenzene-1,3-diol, diacetate
SpectraBase Compound ID H9qvPch8YLj
InChI InChI=1S/C10H9NO6/c1-6(12)16-8-3-4-9(11(14)15)10(5-8)17-7(2)13/h3-5H,1-2H3
InChIKey UOGNFTJSCYHMKN-UHFFFAOYSA-N
Mol Weight 239.18 g/mol
Molecular Formula C10H9NO6
Exact Mass 239.042987 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 66qUT8UqPX0
Name 4-Nitrobenzene-1,3-diol, diacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 239.042987008 u
Formula C10H9NO6
InChI InChI=1S/C10H9NO6/c1-6(12)16-8-3-4-9(11(14)15)10(5-8)17-7(2)13/h3-5H,1-2H3
InChIKey UOGNFTJSCYHMKN-UHFFFAOYSA-N
Molecular Weight 239.183 g/mol
SMILES C1(N(=O)=O)=C(C=C(C=C1)OC(C)=O)OC(C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963655