| SpectraBase Compound ID | Blklz34QeYN |
|---|---|
| InChI | InChI=1S/C20H25N3O3/c1-14(24)21-12-6-5-9-19(22-15(2)25)20(26)23-18-11-10-16-7-3-4-8-17(16)13-18/h3-4,7-8,10-11,13,19H,5-6,9,12H2,1-2H3,(H,21,24)(H,22,25)(H,23,26) |
| InChIKey | MTEGSEUWZVOUKT-UHFFFAOYSA-N |
| Mol Weight | 355.44 g/mol |
| Molecular Formula | C20H25N3O3 |
| Exact Mass | 355.189592 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9WENEe48CTY |
|---|---|
| Name | 2,6-Diamino-hexanoic acid naphthalen-2-ylamide, N,N'-diacetyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 355.189591674 u |
| Formula | C20H25N3O3 |
| InChI | InChI=1S/C20H25N3O3/c1-14(24)21-12-6-5-9-19(22-15(2)25)20(26)23-18-11-10-16-7-3-4-8-17(16)13-18/h3-4,7-8,10-11,13,19H,5-6,9,12H2,1-2H3,(H,21,24)(H,22,25)(H,23,26) |
| InChIKey | MTEGSEUWZVOUKT-UHFFFAOYSA-N |
| Molecular Weight | 355.438 g/mol |
| SMILES | C(NC1=CC2=C(C=C1)C=CC=C2)(C(CCCCNC(C)=O)NC(C)=O)=O |