| SpectraBase Spectrum ID |
FZpTIiRhIYl |
| Name |
6-(1-hydroxypropan-2-yl)-3-(4-(naphthalene-2-sulfonamido)butyl)azulene-1-carboxylic acid |
| Alternate Name(s) |
6-[(2-Hydroxy-1-methyl)ethyl]-3-[4-(2-naphthalenesulfonylamino)butyl]azulene-1-carboxylic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H29NO5S |
| InChI |
InChI=1S/C28H29NO5S/c1-19(18-30)20-10-13-25-23(17-27(28(31)32)26(25)14-11-20)8-4-5-15-29-35(33,34)24-12-9-21-6-2-3-7-22(21)16-24/h2-3,6-7,9-14,16-17,19,29-30H,4-5,8,15,18H2,1H3,(H,31,32) |
| InChIKey |
DSIQLQWEYURZRK-UHFFFAOYSA-N |
| Molecular Weight |
491.602 g/mol |
| SMILES |
OCC(c1ccc2c(c(C(=O)O)cc2CCCCNS(c2cc3ccccc3cc2)(=O)=O)cc1)C |
| SPLASH |
splash10-0002-0900000000-6af672920ad68ff865e4 |
| Source of Spectrum |
G2-4-583-5g |
| Wiley ID |
1661523 |
