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nitroterphthalic acid, dimethyl ester

View entire compound with spectra: 4 NMR, 4 FTIR, 1 Raman, and 1 MS (GC)

nitroterphthalic acid, dimethyl ester
SpectraBase Compound ID EU8wD69DjMi
InChI InChI=1S/C10H9NO6/c1-16-9(12)6-3-4-7(10(13)17-2)8(5-6)11(14)15/h3-5H,1-2H3
InChIKey PAYWCKGMOYQZAW-UHFFFAOYSA-N
Mol Weight 239.18 g/mol
Molecular Formula C10H9NO6
Exact Mass 239.042987 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DsKycj2v0DV
Name Dimethyl nitroterephthalate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 205362
CAS Registry Number 5292-45-5
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO6
InChI InChI=1S/C10H9NO6/c1-16-9(12)6-3-4-7(10(13)17-2)8(5-6)11(14)15/h3-5H,1-2H3
InChIKey PAYWCKGMOYQZAW-UHFFFAOYSA-N
Observed nucleus 1H
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms Dimethyl 2-nitrobenzene-1,4-dicarboxylate
Wiley ID SIAL_1HNMR_002889