SpectraBase Spectrum ID |
4OzsmhMMk91 |
Name |
Methyl 3-Heptyl-2-hydroxy-6-methyl-5-tosylbenzoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H30O5S |
InChI |
InChI=1S/C23H30O5S/c1-5-6-7-8-9-10-18-15-20(17(3)21(22(18)24)23(25)28-4)29(26,27)19-13-11-16(2)12-14-19/h11-15,24H,5-10H2,1-4H3 |
InChIKey |
JOWFBMMUYKUXFO-UHFFFAOYSA-N |
Molecular Weight |
418.548 g/mol |
SMILES |
Oc1c(cc(S(c2ccc(cc2)C)(=O)=O)c(c1C(=O)OC)C)CCCCCCC |
SPLASH |
splash10-0ldi-1119400000-db035086bcb74594c6fa |
Source of Spectrum |
F4-41-2230-4p |
Wiley ID |
1672587 |