| SpectraBase Spectrum ID |
D2uEghDxDqZ |
| Name |
Heptanamide, N-hexyl-N-[3-[methyl-D3-[(4-methylphenyl)sulfonyl]amino]propyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
441.310444629 u |
| Formula |
C24H39[2D]3N2O3S |
| InChI |
InChI=1S/C24H42N2O3S/c1-5-7-9-11-14-24(27)26(20-12-10-8-6-2)21-13-19-25(4)30(28,29)23-17-15-22(3)16-18-23/h15-18H,5-14,19-21H2,1-4H3/i4D3 |
| InChIKey |
SBOJATLNXNTYOS-GKOSEXJESA-N |
| Molecular Weight |
441.689 g/mol |
| SMILES |
C=1(S(N(CCCN(C(=O)CCCCCC)CCCCCC)C([2D])([2D])[2D])(=O)=O)C=CC(=CC1)C |
![Heptanamide, N-hexyl-N-[3-[methyl-D3-[(4-methylphenyl)sulfonyl]amino]propyl]-](/api/spectrum/D2uEghDxDqZ/structure.png?h=300&w=458 "Heptanamide, N-hexyl-N-[3-[methyl-D3-[(4-methylphenyl)sulfonyl]amino]propyl]-")
