![N-Benzyl-2-[1-(p-tolylsulfonyl)ethyl]heptanamide](/api/spectrum/9XAptZNfXk3/structure.png?h=300&w=458 "N-Benzyl-2-[1-(p-tolylsulfonyl)ethyl]heptanamide")
| SpectraBase Compound ID | D1hq3txlkQB |
|---|---|
| InChI | InChI=1S/C23H31NO3S/c1-4-5-7-12-22(23(25)24-17-20-10-8-6-9-11-20)19(3)28(26,27)21-15-13-18(2)14-16-21/h6,8-11,13-16,19,22H,4-5,7,12,17H2,1-3H3,(H,24,25) |
| InChIKey | XSNRFPJXXDSRNJ-UHFFFAOYSA-N |
| Mol Weight | 401.57 g/mol |
| Molecular Formula | C23H31NO3S |
| Exact Mass | 401.202465 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9XAptZNfXk3 |
|---|---|
| Name | N-Benzyl-2-[1-(p-tolylsulfonyl)ethyl]heptanamide |
| Alternate Name(s) | N-benzyl-2-{1-[(4-methylphenyl)sulfonyl]ethyl}heptanamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H31NO3S |
| InChI | InChI=1S/C23H31NO3S/c1-4-5-7-12-22(23(25)24-17-20-10-8-6-9-11-20)19(3)28(26,27)21-15-13-18(2)14-16-21/h6,8-11,13-16,19,22H,4-5,7,12,17H2,1-3H3,(H,24,25) |
| InChIKey | XSNRFPJXXDSRNJ-UHFFFAOYSA-N |
| Molecular Weight | 401.565 g/mol |
| SMILES | N(C(C(CCCCC)C(C)S(=O)(=O)c1ccc(cc1)C)=O)Cc1ccccc1 |
| SPLASH | splash10-0a4i-0900000000-958efaa35b6a81cd84d5 |
| Source of Spectrum | AJ-66-2343-3 |
| Wiley ID | 772184 |