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acetic acid, [[3-(1,3-dioxolan-2-yl)-6-nitro-1-phenyl-1H-indazol-4-yl]thio]-, methyl ester
SpectraBase Compound ID J4NA1BSPySr
InChI InChI=1S/C19H17N3O6S/c1-26-16(23)11-29-15-10-13(22(24)25)9-14-17(15)18(19-27-7-8-28-19)20-21(14)12-5-3-2-4-6-12/h2-6,9-10,19H,7-8,11H2,1H3
InChIKey OLFPJRKLDRVGRL-UHFFFAOYSA-N
Mol Weight 415.42 g/mol
Molecular Formula C19H17N3O6S
Exact Mass 415.083806 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EjcTr4Zs391
Name acetic acid, [[3-(1,3-dioxolan-2-yl)-6-nitro-1-phenyl-1H-indazol-4-yl]thio]-, 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 415.083806447 u
Formula C19H17N3O6S
InChI InChI=1S/C19H17N3O6S/c1-26-16(23)11-29-15-10-13(22(24)25)9-14-17(15)18(19-27-7-8-28-19)20-21(14)12-5-3-2-4-6-12/h2-6,9-10,19H,7-8,11H2,1H3
InChIKey OLFPJRKLDRVGRL-UHFFFAOYSA-N
Molecular Weight 415.420 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16702
Solvent DMSO-d6
Source Vendor ID: NMR/11230134; Lab Info: DAL; Lab Number: Vin-0045