| SpectraBase Spectrum ID |
CzNwKHdDs0n |
| Name |
butyl 3-(4-(4-chlorophenylsulfonamido)butyl)-6-(2,2,4-trimethyl-1,3-dioxolan-4-yl)azulene-1-sulfonate |
| Alternate Name(s) |
n-Butyl 3-[4-(4-chlorobenzenesulfonylamino)butyl]-6-(2,2,4-trimethyl-l,3-dioxolane-4-yl)azulene-1-sulfonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H38ClNO7S2 |
| InChI |
InChI=1S/C30H38ClNO7S2/c1-5-6-19-38-41(35,36)28-20-22(9-7-8-18-32-40(33,34)25-14-12-24(31)13-15-25)26-16-10-23(11-17-27(26)28)30(4)21-37-29(2,3)39-30/h10-17,20,32H,5-9,18-19,21H2,1-4H3 |
| InChIKey |
VLZKBERMDGOAOI-UHFFFAOYSA-N |
| Molecular Weight |
624.207 g/mol |
| SMILES |
N(S(c1ccc(cc1)Cl)(=O)=O)CCCCc1cc(S(=O)(=O)OCCCC)c2c1ccc(C1(OC(C)(C)OC1)C)cc2 |
| SPLASH |
splash10-0a4i-9000000000-f3644ddde874671631bf |
| Source of Spectrum |
G2-4-587-21 |
| Wiley ID |
1661613 |
