SpectraBase Spectrum ID |
G2uvr8nuxgU |
Name |
5-methoxy-7-methylsulfonyloxy-1H-indole-2-carboxylic acid ethyl ester |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H15NO6S |
InChI |
InChI=1S/C13H15NO6S/c1-4-19-13(15)10-6-8-5-9(18-2)7-11(12(8)14-10)20-21(3,16)17/h5-7,14H,4H2,1-3H3 |
InChIKey |
SSMBEWGBQMCNFS-UHFFFAOYSA-N |
Molecular Weight |
313.324 g/mol |
SMILES |
[nH]1c2c(cc(cc2cc1C(=O)OCC)OC)OS(=O)(=O)C |
SPLASH |
splash10-001i-0093000000-9b3666c56300c38ebca7 |
Source of Spectrum |
E2-47-797-14 |
Wiley ID |
1554896 |