| SpectraBase Spectrum ID |
DUakMgVRS1k |
| Name |
1,3-Dimethylbutyl benzenesulfonate |
| Alternate Name(s) |
benzenesulfonic acid 4-methylpentan-2-yl ester
4-Methylpentan-2-yl benzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O3S |
| InChI |
InChI=1S/C12H18O3S/c1-10(2)9-11(3)15-16(13,14)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3 |
| InChIKey |
YBEBACLSSPNIIP-UHFFFAOYSA-N |
| Molecular Weight |
242.333 g/mol |
| SMILES |
c1(ccccc1)S(=O)(=O)OC(CC(C)C)C |
| SPLASH |
splash10-000f-0900000000-2f46a44777df160e7af5 |
| Source of Spectrum |
U1-2002-2751-0 |
| Wiley ID |
1522989 |
