| SpectraBase Compound ID | 6cCNWdUnqn |
|---|---|
| InChI | InChI=1S/C25H29N3O5S/c29-24(27-21-4-2-5-22(13-21)28(30)31)20-3-1-6-23(12-20)34(32,33)26-8-7-25-14-17-9-18(15-25)11-19(10-17)16-25/h1-6,12-13,17-19,26H,7-11,14-16H2,(H,27,29)/t17-,18+,19-,25+ |
| InChIKey | LINFBAOBSWGIKK-ARJLHZIISA-N |
| Mol Weight | 483.58 g/mol |
| Molecular Formula | C25H29N3O5S |
| Exact Mass | 483.182792 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ANbfmGn4cCn |
|---|---|
| Name | 3-(2-Adamantan-1-yl-ethylsulfamoyl)-N-(3-nitro-phenyl)-benzamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H29N3O5S |
| InChI | InChI=1S/C25H29N3O5S/c29-24(27-21-4-2-5-22(13-21)28(30)31)20-3-1-6-23(12-20)34(32,33)26-8-7-25-14-17-9-18(15-25)11-19(10-17)16-25/h1-6,12-13,17-19,26H,7-11,14-16H2,(H,27,29)/t17-,18+,19-,25+ |
| InChIKey | LINFBAOBSWGIKK-ARJLHZIISA-N |
| Molecular Weight | 483.583 g/mol |
| SMILES | N(C(c1cc(S(=O)(=O)NCCC23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])ccc1)=O)c1cc(N(=O)=O)ccc1 |
| SPLASH | splash10-002u-6901000000-f36324f836a4ccfb2f14 |
| Source of Spectrum | IY-1-4446-2 |
| Wiley ID | 1652445 |