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Methyl 3,4,5-trimethoxy-2,6-dinitrobenzoate
SpectraBase Compound ID FjaKq1G9sH2
InChI InChI=1S/C11H12N2O9/c1-19-8-6(12(15)16)5(11(14)22-4)7(13(17)18)9(20-2)10(8)21-3/h1-4H3
InChIKey AAMUAUAHCKODNJ-UHFFFAOYSA-N
Mol Weight 316.22 g/mol
Molecular Formula C11H12N2O9
Exact Mass 316.05428 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FP2ZqIlyVeF
Name benzoic acid, 3,4,5-trimethoxy-2,6-dinitro-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 316.054279965 u
Formula C11H12N2O9
InChI InChI=1S/C11H12N2O9/c1-19-8-6(12(15)16)5(11(14)22-4)7(13(17)18)9(20-2)10(8)21-3/h1-4H3
InChIKey AAMUAUAHCKODNJ-UHFFFAOYSA-N
Molecular Weight 316.222 g/mol
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4414
Solvent DMSO-d6
Source Vendor ID: NMR/9254268; Lab Info: LP; Lab Number: LP-4079001