| SpectraBase Spectrum ID |
InZEcqmAtrE |
| Name |
(2-formyl-1H-indol-7-yl) 4-methylbenzenesulfonate |
| Alternate Name(s) |
(2-methanoyl-1H-indol-7-yl) 4-methylbenzenesulfonate
4-methylbenzenesulfonic acid (2-formyl-1H-indol-7-yl) ester |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13NO4S |
| InChI |
InChI=1S/C16H13NO4S/c1-11-5-7-14(8-6-11)22(19,20)21-15-4-2-3-12-9-13(10-18)17-16(12)15/h2-10,17H,1H3 |
| InChIKey |
WLRGOHPJZKSYGM-UHFFFAOYSA-N |
| Molecular Weight |
315.343 g/mol |
| SMILES |
[nH]1c(cc2cccc(c12)OS(c1ccc(cc1)C)(=O)=O)C=O |
| SPLASH |
splash10-03xr-0908000000-803f73507c1c428fc6ce |
| Source of Spectrum |
KC-0-1720-10 |
| Wiley ID |
828482 |
