| SpectraBase Compound ID | CD2RI5ER9UR |
|---|---|
| InChI | InChI=1S/C14H23NO6/c1-9(11(16)19-5)7-8-10(12(17)20-6)15-13(18)21-14(2,3)4/h10H,1,7-8H2,2-6H3,(H,15,18)/t10-/m0/s1 |
| InChIKey | MHGRKBSCLWIFCI-JTQLQIEISA-N |
| Mol Weight | 301.34 g/mol |
| Molecular Formula | C14H23NO6 |
| Exact Mass | 301.152537 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DNFXwRmVXZq |
|---|---|
| Name | (2S)-2-(Tert-butoxycarbonylamino)-5-methylene-adipic acid dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 301.152537459 u |
| Formula | C14H23NO6 |
| InChI | InChI=1S/C14H23NO6/c1-9(11(16)19-5)7-8-10(12(17)20-6)15-13(18)21-14(2,3)4/h10H,1,7-8H2,2-6H3,(H,15,18)/t10-/m0/s1 |
| InChIKey | MHGRKBSCLWIFCI-JTQLQIEISA-N |
| SMILES | C(N[C@](C(=O)OC)(CCC(C(=O)OC)=C)[H])(OC(C)(C)C)=O |