| SpectraBase Spectrum ID |
DmmD0SPlE9p |
| Name |
n-Butyl 3-[4-(4-chlorobenzenesulfonylamino)butyl]-6-isopropylazulene-1-sulfonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H34ClNO5S2 |
| InChI |
InChI=1S/C27H34ClNO5S2/c1-4-5-18-34-36(32,33)27-19-22(25-15-9-21(20(2)3)10-16-26(25)27)8-6-7-17-29-35(30,31)24-13-11-23(28)12-14-24/h9-16,19-20,29H,4-8,17-18H2,1-3H3 |
| InChIKey |
QPCSPIKWCYCZCY-UHFFFAOYSA-N |
| Molecular Weight |
552.144 g/mol |
| SMILES |
N(S(c1ccc(cc1)Cl)(=O)=O)CCCCc1cc(S(=O)(=O)OCCCC)c2c1ccc(cc2)C(C)C |
| SPLASH |
splash10-03di-0900000000-d6dbb072ff725ddb1a9e |
| Source of Spectrum |
G2-4-585-12c |
| Wiley ID |
1661513 |
![n-Butyl 3-[4-(4-chlorobenzenesulfonylamino)butyl]-6-isopropylazulene-1-sulfonate](/api/spectrum/DmmD0SPlE9p/structure.png?h=300&w=458 "n-Butyl 3-[4-(4-chlorobenzenesulfonylamino)butyl]-6-isopropylazulene-1-sulfonate")
