| SpectraBase Spectrum ID |
PPS2T6jMO |
| Name |
1-Propanol, 1,1-dideutero-, 2,2-dimethyl-, 4-methylbenzenesulfonate |
| Alternate Name(s) |
1-Propanol, 1,1-dideutero-, 2,2-dimethyl-, p-toluenesulfonate
1,1-Dideutero-2,2-dimethylpropyl 4-methylbenzenesulfonate
4-Methylbenzenesulfonic acid , 1,1-dideutero-2,2-dimethylpropyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16D2O3S |
| InChI |
InChI=1S/C12H18O3S/c1-10-5-7-11(8-6-10)16(13,14)15-9-12(2,3)4/h5-8H,9H2,1-4H3/i9D2 |
| InChIKey |
ZIUSUDLSXJPGTD-KNXIQCGSSA-N |
| Molecular Weight |
244.345 g/mol |
| SMILES |
C(OS(c1ccc(cc1)C)(=O)=O)(C(C)(C)C)([D])[D] |
| SPLASH |
splash10-0a4i-4900000000-fa8afc59aea0773bfefb |
| Source of Spectrum |
O-20-749-5 |
| Wiley ID |
1244810 |
