| SpectraBase Spectrum ID |
1AyopPSAWzP |
| Name |
4-(Bromomethyl)-2-adamantyl 4-nitrobenzenesulfonate |
| CAS Registry Number |
274255-39-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20BrNO5S |
| InChI |
InChI=1S/C17H20BrNO5S/c18-9-16-11-5-10-6-12(8-11)17(15(16)7-10)24-25(22,23)14-3-1-13(2-4-14)19(20)21/h1-4,10-12,15-17H,5-9H2/t10-,11+,12-,15+,16?,17-/m0/s1 |
| InChIKey |
QEFDBEIHKLONII-YYJVAGPMSA-N |
| Molecular Weight |
430.313 g/mol |
| SMILES |
C(C1[C@@]2([C@@](OS(c3ccc(N(=O)=O)cc3)(=O)=O)([C@@]3(C[C@]1(C[C@@](C3)(C2)[H])[H])[H])[H])[H])Br |
| SPLASH |
splash10-0005-9810000000-1d1dd56efb74bb6038d5 |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
Benzenesulfonic acid, 4-nitro-, (4-bromomethyl-2-adamantyl) ester
[4-(bromomethyl)-2-adamantyl] 4-nitrobenzenesulfonate |
| Wiley ID |
1431233 |
