| SpectraBase Spectrum ID |
3ofFCQ91EEG |
| Name |
acetic acid, [[2,4-dinitro-6-[(phenylmethyl)sulfinyl]benzoyl]amino]-,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 |
421.057985621 u |
| Formula |
C17H15N3O8S |
| InChI |
InChI=1S/C17H15N3O8S/c1-28-15(21)9-18-17(22)16-13(20(25)26)7-12(19(23)24)8-14(16)29(27)10-11-5-3-2-4-6-11/h2-8H,9-10H2,1H3,(H,18,22) |
| InChIKey |
WQLJEPCRHZSYFJ-UHFFFAOYSA-N |
| Molecular Weight |
421.380 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11683 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10241867; Lab Info: L-17; Lab Number: Serebryakov,L-12 |
![acetic acid, [[2,4-dinitro-6-[(phenylmethyl)sulfinyl]benzoyl]amino]-,methyl ester](/api/spectrum/3ofFCQ91EEG/structure.png?h=300&w=458 "acetic acid, [[2,4-dinitro-6-[(phenylmethyl)sulfinyl]benzoyl]amino]-,methyl ester")
