| SpectraBase Spectrum ID |
KTvL2LcteRD |
| Name |
4-hydroxy-3,5-di(propan-2-yl)benzenesulfonic acid methyl ester |
| Alternate Name(s) |
4-hydroxy-3,5-diisopropyl-benzenesulfonic acid methyl ester
methyl 4-hydroxy-3,5-di(propan-2-yl)benzenesulfonate
methyl 4-hydroxy-3,5-diisopropyl-benzenesulfonate
methyl 4-oxidanyl-3,5-di(propan-2-yl)benzenesulfonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O4S |
| InChI |
InChI=1S/C13H20O4S/c1-8(2)11-6-10(18(15,16)17-5)7-12(9(3)4)13(11)14/h6-9,14H,1-5H3 |
| InChIKey |
PQIIOMBIBBQSPZ-UHFFFAOYSA-N |
| Molecular Weight |
272.359 g/mol |
| SMILES |
Oc1c(cc(S(=O)(=O)OC)cc1C(C)C)C(C)C |
| SPLASH |
splash10-0a4i-0090000000-0a276c90ffa0349c2a0f |
| Source of Spectrum |
F2-41-1851-6 |
| Wiley ID |
1599683 |
