| SpectraBase Compound ID | 8nJsDzlbfET |
|---|---|
| InChI | InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-12(17)8-10(15)13(18)19/h2-6,10-11H,7-8,15H2,1H3,(H,16,17)(H,18,19)/t10-,11-/m0/s1 |
| InChIKey | SHHIPKDJQYIJJF-QWRGUYRKSA-N |
| Mol Weight | 294.31 g/mol |
| Molecular Formula | C14H18N2O5 |
| Exact Mass | 294.121572 g/mol |
13C Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | LWR37ylpGOk |
|---|---|
| Name | beta-Asp-Phe methyl ester |
| Source of Sample | Sigma-Aldrich Co. LLC. |
| Catalog Number | 421677 |
| CAS Registry Number | 22839-61-8 |
| Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H18N2O5 |
| InChI | InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-12(17)8-10(15)13(18)19/h2-6,10-11H,7-8,15H2,1H3,(H,16,17)(H,18,19)/t10-,11-/m0/s1 |
| InChIKey | SHHIPKDJQYIJJF-QWRGUYRKSA-N |
| Observed nucleus | 13C |
| Purity | 96% |
| Solvent | DMSO-d6 |
| Source of Spectrum | Sigma-Aldrich Co. LLC. |
| Synonyms | N-beta-L-Aspartyl-L-phenylalanine methyl ester |
| Wiley ID | SIAL_13CNMR_009345 |