![2-(Cyclohexen-1-yl)ethyl-[4-ethoxy-6-(p-phenetidino)-S-triazin-2-yl]amine](/api/spectrum/FAvHeZLw2PA/structure.png?h=300&w=458 "2-(Cyclohexen-1-yl)ethyl-[4-ethoxy-6-(p-phenetidino)-S-triazin-2-yl]amine")
| SpectraBase Compound ID | KvKkiWxA6Hw |
|---|---|
| InChI | InChI=1S/C21H29N5O2/c1-3-27-18-12-10-17(11-13-18)23-20-24-19(25-21(26-20)28-4-2)22-15-14-16-8-6-5-7-9-16/h8,10-13H,3-7,9,14-15H2,1-2H3,(H2,22,23,24,25,26) |
| InChIKey | OELZMZJHALZKMT-UHFFFAOYSA-N |
| Mol Weight | 383.5 g/mol |
| Molecular Formula | C21H29N5O2 |
| Exact Mass | 383.232125 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FAvHeZLw2PA |
|---|---|
| Name | 2-(Cyclohexen-1-yl)ethyl-[4-ethoxy-6-(p-phenetidino)-S-triazin-2-yl]amine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 383.232125192 u |
| Formula | C21H29N5O2 |
| InChI | InChI=1S/C21H29N5O2/c1-3-27-18-12-10-17(11-13-18)23-20-24-19(25-21(26-20)28-4-2)22-15-14-16-8-6-5-7-9-16/h8,10-13H,3-7,9,14-15H2,1-2H3,(H2,22,23,24,25,26) |
| InChIKey | OELZMZJHALZKMT-UHFFFAOYSA-N |
| Molecular Weight | 383.496 g/mol |
| SMILES | C1(=NC(NCCC2=CCCCC2)=NC(=N1)OCC)NC1=CC=C(C=C1)OCC |