| SpectraBase Spectrum ID |
4IoDB1dD97S |
| Name |
1-Tosyl-5-cinnamyl-3-methoxy-4-methoxycarbonyl-3-pyrrolin-2-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21NO6S |
| InChI |
InChI=1S/C22H21NO6S/c1-15-9-12-17(13-10-15)30(26,27)23-18(14-11-16-7-5-4-6-8-16)19(22(25)29-3)20(28-2)21(23)24/h4-14,18H,1-3H3/b14-11+ |
| InChIKey |
BQGNPFSFKRWXGD-SDNWHVSQSA-N |
| Molecular Weight |
427.471 g/mol |
| SMILES |
c1(S(N2C(C(OC)=C(C2\C=C\c2ccccc2)C(=O)OC)=O)(=O)=O)ccc(cc1)C |
| SPLASH |
splash10-00di-0090100000-220df102ae47f43ebb76 |
| Source of Spectrum |
J-63-5040-12i |
| Wiley ID |
1380372 |
