| SpectraBase Compound ID | 3RdTMR9v9fb |
|---|---|
| InChI | InChI=1S/C9H16N2O4/c1-5(10-7(3)12)8(13)11-6(2)9(14)15-4/h5-6H,1-4H3,(H,10,12)(H,11,13) |
| InChIKey | CXWPLQYKHLCSPO-UHFFFAOYSA-N |
| Mol Weight | 216.24 g/mol |
| Molecular Formula | C9H16N2O4 |
| Exact Mass | 216.111007 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CBuYyKl5vIp |
|---|---|
| Name | n-Acetyl-alanyl-alanine methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H16N2O4 |
| InChI | InChI=1S/C9H16N2O4/c1-5(10-7(3)12)8(13)11-6(2)9(14)15-4/h5-6H,1-4H3,(H,10,12)(H,11,13) |
| InChIKey | CXWPLQYKHLCSPO-UHFFFAOYSA-N |
| Ionization Type | EI-B |
| Molecular Weight | 216.237 g/mol |
| SMILES | N(C(C(OC)=O)C)C(C(C)NC(C)=O)=O |
| SPLASH | splash10-0006-9000000000-f1e5c2f4a9ce9214184f |
| Source of Spectrum | SRH-2022-294-0 |
| Wiley ID | 1822798 |