| SpectraBase Spectrum ID |
I3kjwPslQa6 |
| Name |
Benzenesulfonic acid, 4-methyl-, (4-chloro-1-adamantyl) ester |
| Alternate Name(s) |
4-Chloro-1-adamantyl 4-methylbenzenesulfonate
(4-chloro-1-adamantyl) 4-methylbenzenesulfonate
(4-chloranyl-1-adamantyl) 4-methylbenzenesulfonate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21ClO3S |
| InChI |
InChI=1S/C17H21ClO3S/c1-11-2-4-15(5-3-11)22(19,20)21-17-8-12-6-13(9-17)16(18)14(7-12)10-17/h2-5,12-14,16H,6-10H2,1H3/t12-,13-,14+,16?,17- |
| InChIKey |
HYGWPHUFSDNPCH-VVRCZGOQSA-N |
| Molecular Weight |
340.865 g/mol |
| SMILES |
Cc1ccc(S(O[C@]23C[C@@]4(C[C@@](C3)(C[C@](C2)(C4Cl)[H])[H])[H])(=O)=O)cc1 |
| SPLASH |
splash10-014l-9700000000-4b2b580662884d81f0c9 |
| Source of Spectrum |
AD-0-2532-0 |
| Wiley ID |
1432606 |
