| SpectraBase Spectrum ID |
LeklAn1YdK2 |
| Name |
acetic acid, [[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 |
431.060963002 u |
| Formula |
C19H17N3O5S2 |
| InChI |
InChI=1S/C19H17N3O5S2/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 |
FQAPXMXRLSKHHI-UHFFFAOYSA-N |
| Molecular Weight |
431.481 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16698 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11230125; Lab Info: DAL; Lab Number: Vin-0036 |
![acetic acid, [[6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-1H-indazol-4-yl]thio]-, methyl ester](/api/spectrum/LeklAn1YdK2/structure.png?h=300&w=458 "acetic acid, [[6-nitro-3-(1,3-oxathiolan-2-yl)-1-phenyl-1H-indazol-4-yl]thio]-, methyl ester")
