| SpectraBase Spectrum ID |
DBhBKpXkq7c |
| Name |
4-(1,1,4,4,7-pentamethyltetralin-6-yl)sulfinylbenzoic acid |
| Alternate Name(s) |
4-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)sulfinyl]benzoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O3S |
| InChI |
InChI=1S/C22H26O3S/c1-14-12-17-18(22(4,5)11-10-21(17,2)3)13-19(14)26(25)16-8-6-15(7-9-16)20(23)24/h6-9,12-13H,10-11H2,1-5H3,(H,23,24) |
| InChIKey |
OHQAFFBBAIJBPR-UHFFFAOYSA-N |
| Molecular Weight |
370.507 g/mol |
| SMILES |
OC(c1ccc(S(c2cc3C(CCC(c3cc2C)(C)C)(C)C)=O)cc1)=O |
| SPLASH |
splash10-0a4i-0009000000-03fc07546414b8787167 |
| Source of Spectrum |
E1-39-3561-3 |
| Wiley ID |
1598957 |
