| SpectraBase Compound ID | 3qCwOfTyDX1 |
|---|---|
| InChI | InChI=1S/C12H16N2O3/c1-8(12(16)17)14-11(15)10(13)7-9-5-3-2-4-6-9/h2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17) |
| InChIKey | MIDZLCFIAINOQN-UHFFFAOYSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C12H16N2O3 |
| Exact Mass | 236.116092 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EkWoiRriMVN |
|---|---|
| Name | Phenylalanyl-alanine |
| CAS Registry Number | 6491-63-0 |
| Comments | PH=9,LOCK:DNO3 ENRICHED |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H16N2O3 |
| InChI | InChI=1S/C12H16N2O3/c1-8(12(16)17)14-11(15)10(13)7-9-5-3-2-4-6-9/h2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17) |
| InChIKey | MIDZLCFIAINOQN-UHFFFAOYSA-N |
| Instrument Name | Bruker WH-180 |
| Literature Reference | V. Markowski et. al., Proc. Natl. Acad. Sci. USA 74, 1308 (1977). |
| NMR Standard | CH3NO2 |
| Observed nucleus | 15N |
| Solvent | H2O |