| SpectraBase Spectrum ID |
7mEkmD63MOB |
| Name |
carbamimidothioic acid, N-(1,3-benzodioxol-5-ylmethyl)-N'-(4-ethoxyphenyl)-, 2,5-dioxo-1-phenyl-3-pyrrolidinyl 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 |
503.151492086 u |
| Formula |
C27H25N3O5S |
| InChI |
InChI=1S/C27H25N3O5S/c1-2-33-21-11-9-19(10-12-21)29-27(28-16-18-8-13-22-23(14-18)35-17-34-22)36-24-15-25(31)30(26(24)32)20-6-4-3-5-7-20/h3-14,24H,2,15-17H2,1H3,(H,28,29) |
| InChIKey |
JLJGOMNYIRFYSM-UHFFFAOYSA-N |
| Molecular Weight |
503.573 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1391 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8173558; Lab Info: PE; Lab Number: PE-0005266 |
