| SpectraBase Compound ID | 9gECZNeU0Hu |
|---|---|
| InChI | InChI=1S/C20H29N3O6S/c1-13(17(24)22-14(2)19(26)28-3)21-18(25)16(10-11-30-4)23-20(27)29-12-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3,(H,21,25)(H,22,24)(H,23,27)/t13-,14-,16-/m0/s1 |
| InChIKey | MRBBEEZHNKAWRY-DZKIICNBSA-N |
| Mol Weight | 439.53 g/mol |
| Molecular Formula | C20H29N3O6S |
| Exact Mass | 439.177707 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BV67d4FvLxi |
|---|---|
| Name | METHYL-N-(BENZYLOXYCARBONYL)-METHIONYLALANYLALANINE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H29N3O6S |
| InChI | InChI=1S/C20H29N3O6S/c1-13(17(24)22-14(2)19(26)28-3)21-18(25)16(10-11-30-4)23-20(27)29-12-15-8-6-5-7-9-15/h5-9,13-14,16H,10-12H2,1-4H3,(H,21,25)(H,22,24)(H,23,27)/t13-,14-,16-/m0/s1 |
| InChIKey | MRBBEEZHNKAWRY-DZKIICNBSA-N |
| Literature Reference Author | H.R.KRICHELDORF |
| Literature Reference Citation | ORG.MAGN.RES.,15,162(1981) |
| Literature Reference DOI | 10.1002/mrc.1270150211 |
| Solvent | DMSO |
| Source File Reference | UWCS17451 |