| SpectraBase Spectrum ID |
Gq5TfFXSIgP |
| Name |
propanoic acid, 3-[[6-nitro-3-(1,3-oxathiolan-2-yl)-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 |
445.076613067 u |
| Formula |
C20H19N3O5S2 |
| InChI |
InChI=1S/C20H19N3O5S2/c1-27-17(24)7-9-29-16-12-14(23(25)26)11-15-18(16)19(20-28-8-10-30-20)21-22(15)13-5-3-2-4-6-13/h2-6,11-12,20H,7-10H2,1H3 |
| InChIKey |
KOIQELYDMNKNLV-UHFFFAOYSA-N |
| Molecular Weight |
445.508 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15849 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11230126; Lab Info: DAL; Lab Number: Vin-0037 |
![propanoic acid, 3-[[6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-1H-indazol-4-yl]thio]-, methyl ester](/api/spectrum/Gq5TfFXSIgP/structure.png?h=300&w=458 "propanoic acid, 3-[[6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-1H-indazol-4-yl]thio]-, methyl ester")
