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methyl 3-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate
SpectraBase Compound ID JyeYsdzW6e1
InChI InChI=1S/C11H10N4O4/c1-19-10(16)9-4-2-3-8(5-9)6-14-7-12-11(13-14)15(17)18/h2-5,7H,6H2,1H3
InChIKey XICVJHWVDUIFOS-UHFFFAOYSA-N
Mol Weight 262.22 g/mol
Molecular Formula C11H10N4O4
Exact Mass 262.070205 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BgJj51D4MgC
Name methyl 3-[(3-nitro-1H-1,2,4-triazol-1-yl)methyl]benzoate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.070204814 u
Formula C11H10N4O4
InChI InChI=1S/C11H10N4O4/c1-19-10(16)9-4-2-3-8(5-9)6-14-7-12-11(13-14)15(17)18/h2-5,7H,6H2,1H3
InChIKey XICVJHWVDUIFOS-UHFFFAOYSA-N
Molecular Weight 262.225 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_9147
Solvent DMSO-d6
Source Vendor ID: NMR/13228418