| SpectraBase Spectrum ID |
KA5SZuJ3GrS |
| Name |
Methyl 6-hydroxy-6-[1-(phenylsulfonyl)-(1H)-pyrrol-3-yl)-2-hexenoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO5S |
| InChI |
InChI=1S/C17H19NO5S/c1-23-17(20)10-6-5-9-16(19)14-11-12-18(13-14)24(21,22)15-7-3-2-4-8-15/h2-4,6-8,10-13,16,19H,5,9H2,1H3/b10-6+ |
| InChIKey |
LRMXXLWJMNXCMP-UXBLZVDNSA-N |
| Molecular Weight |
349.401 g/mol |
| SMILES |
OC(c1c[n](S(=O)(=O)c2ccccc2)cc1)CC\C=C\C(=O)OC |
| SPLASH |
splash10-000i-0090000000-f2a90aa373be4ee8c598 |
| Source of Spectrum |
E1-39-2834-0 |
| Wiley ID |
1519175 |
