![N-N-Octadecyl-N'-2-[N-aziridyl]ethylthiourea](/api/spectrum/42Jk9dXIbr8/structure.png?h=300&w=458 "N-N-Octadecyl-N'-2-[N-aziridyl]ethylthiourea")
| SpectraBase Compound ID | 9ztvQPI7FUf |
|---|---|
| InChI | InChI=1S/C23H47N3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-23(27)25-19-20-26-21-22-26/h2-22H2,1H3,(H2,24,25,27) |
| InChIKey | HLQZRSRPTJLQQE-UHFFFAOYSA-N |
| Mol Weight | 397.7 g/mol |
| Molecular Formula | C23H47N3S |
| Exact Mass | 397.34907 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 42Jk9dXIbr8 |
|---|---|
| Name | N-N-Octadecyl-N'-2-[N-aziridyl]ethylthiourea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 397.349069699 u |
| Formula | C23H47N3S |
| InChI | InChI=1S/C23H47N3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-23(27)25-19-20-26-21-22-26/h2-22H2,1H3,(H2,24,25,27) |
| InChIKey | HLQZRSRPTJLQQE-UHFFFAOYSA-N |
| Molecular Weight | 397.710 g/mol |
| SMILES | CCCCCCCCCCCCCCCCCCNC(NCCN1CC1)=S |