| SpectraBase Compound ID | 9TnaDmwvP4e |
|---|---|
| InChI | InChI=1S/C7H11NO4.Cl/c1-2-3-12-6(9)4-5(8)7(10)11;/h2,5H,1,3-4,8H2,(H,10,11);/t5-;/m1./s1 |
| InChIKey | ONBJASPLEJMVIQ-NUBCRITNSA-N |
| Mol Weight | 208.62 g/mol |
| Molecular Formula | C7H11ClNO4 |
| Exact Mass | 208.037661 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KmJ0nQYJ4Sp |
|---|---|
| Name | .beta.-Allyl (2R)-aspartate ester hydrochoride |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12ClNO4 |
| InChI | InChI=1S/C7H11NO4.Cl/c1-2-3-12-6(9)4-5(8)7(10)11;/h2,5H,1,3-4,8H2,(H,10,11);/t5-;/m1./s1 |
| InChIKey | ONBJASPLEJMVIQ-NUBCRITNSA-N |
| Molecular Weight | 209.629 g/mol |
| SMILES | Cl.OC([C@@](CC(=O)OCC=C)(N)[H])=O |
| SPLASH | splash10-00bc-9800000000-1ac3785e6153078d865b |
| Source of Spectrum | K-2001-1683-12 |
| Wiley ID | 1579335 |