SpectraBase Spectrum ID |
4Q6rSIamH2w |
Name |
Methyl 3-(4-Chlorophenylsulfonyl)-5-octyl-6-hydroxy-2-methylbenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H29ClO5S |
InChI |
InChI=1S/C23H29ClO5S/c1-4-5-6-7-8-9-10-17-15-20(16(2)21(22(17)25)23(26)29-3)30(27,28)19-13-11-18(24)12-14-19/h11-15,25H,4-10H2,1-3H3 |
InChIKey |
MSUNTSCPMICTNW-UHFFFAOYSA-N |
Molecular Weight |
452.993 g/mol |
SMILES |
Oc1c(cc(S(c2ccc(cc2)Cl)(=O)=O)c(c1C(=O)OC)C)CCCCCCCC |
SPLASH |
splash10-0fk9-0009700000-d1f44e1dd4d1c4003c3e |
Source of Spectrum |
F4-41-2232-4y |
Wiley ID |
1672578 |