| SpectraBase Compound ID | B9C2lWMrQ9J |
|---|---|
| InChI | InChI=1S/C22H40N4O6/c1-11(2)10-16(19(28)23-14(7)22(31)32-9)25-20(29)18(13(5)6)26-21(30)17(12(3)4)24-15(8)27/h11-14,16-18H,10H2,1-9H3,(H,23,28)(H,24,27)(H,25,29)(H,26,30)/t14-,16-,17-,18-/m0/s1 |
| InChIKey | ZXKBPODMCPOKMX-DKIMLUQUSA-N |
| Mol Weight | 456.6 g/mol |
| Molecular Formula | C22H40N4O6 |
| Exact Mass | 456.294785 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CIUoR8zCDnJ |
|---|---|
| Name | n-Acetyl-valyl-valyl-leucyl-alanine methylester |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H40N4O6 |
| InChI | InChI=1S/C22H40N4O6/c1-11(2)10-16(19(28)23-14(7)22(31)32-9)25-20(29)18(13(5)6)26-21(30)17(12(3)4)24-15(8)27/h11-14,16-18H,10H2,1-9H3,(H,23,28)(H,24,27)(H,25,29)(H,26,30)/t14-,16-,17-,18-/m0/s1 |
| InChIKey | ZXKBPODMCPOKMX-DKIMLUQUSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 456.584 g/mol |
| SMILES | N([C@](C(=O)OC)(C)[H])C([C@@](NC([C@@](NC([C@@](NC(=O)C)(C(C)C)[H])=O)(C(C)C)[H])=O)(CC(C)C)[H])=O |
| SPLASH | splash10-00dl-9200000000-8ab7d39427ff908dd90f |
| Source of Spectrum | SRH-2022-2605-0 |
| Wiley ID | 1824960 |