| SpectraBase Compound ID | 1nWT0aqV5nT |
|---|---|
| InChI | InChI=1S/C14H24N6O4/c15-4-2-1-3-9(14(23)24)20-13(22)10(19-12(21)8-16)7-11-17-5-6-18-11/h5-6,9-10H,1-4,7-8,15-16H2,(H,17,18)(H,19,21)(H,20,22)(H,23,24)/t9-,10-/m0/s1 |
| InChIKey | GSUKPJSGTUCPTL-UWVGGRQHSA-N |
| Mol Weight | 340.38 g/mol |
| Molecular Formula | C14H24N6O4 |
| Exact Mass | 340.185903 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2oYRqVlK7HJ |
|---|---|
| Name | Glycyl-L-histidyl-L-lysine acetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 340.185903273 u |
| Formula | C14H24N6O4 |
| InChI | InChI=1S/C14H24N6O4/c15-4-2-1-3-9(14(23)24)20-13(22)10(19-12(21)8-16)7-11-17-5-6-18-11/h5-6,9-10H,1-4,7-8,15-16H2,(H,17,18)(H,19,21)(H,20,22)(H,23,24)/t9-,10-/m0/s1 |
| InChIKey | GSUKPJSGTUCPTL-UWVGGRQHSA-N |
| Molecular Weight | 340.384 g/mol |
| SMILES | C1=CN=C(N1)C[C@](NC(CN)=O)(C(N[C@](C(=O)O)(CCCCN)[H])=O)[H] |