| SpectraBase Spectrum ID |
7VeDhRXg2C2 |
| Name |
(E)-3-Methoxycarbonyl-2-propenyl-3-(di-t-butylmethylene)-2-(p-nitrophenyl)thiirane-2-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H29NO6S |
| InChI |
InChI=1S/C23H29NO6S/c1-21(2,3)18(22(4,5)6)19-23(31-19,15-10-12-16(13-11-15)24(27)28)20(26)30-14-8-9-17(25)29-7/h8-13H,14H2,1-7H3/b9-8+ |
| InChIKey |
AWCSTKVHSPQQCF-CMDGGOBGSA-N |
| Molecular Weight |
447.546 g/mol |
| SMILES |
C1(C(=C(C(C)(C)C)C(C)(C)C)S1)(C(=O)OC\C=C\C(=O)OC)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-0007-0090500000-9bef014fb00e87697a8d |
| Source of Spectrum |
AJ-68-1399-14 |
| Synonyms |
(2E)-4-methoxy-4-oxo-2-butenyl 3-(1-tert-butyl-2,2-dimethylpropylidene)-2-(4-nitrophenyl)-2-thiiranecarboxylate |
| Wiley ID |
773309 |
