| SpectraBase Compound ID | 521EltmF8rn |
|---|---|
| InChI | InChI=1S/C25H28N2O6/c1-25(2,3)33-24(29)26-21(12-15-13-22(15)27(30)31)23(28)32-14-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20/h4-11,15,20-22H,12-14H2,1-3H3,(H,26,29)/t15-,21+,22?/m1/s1 |
| InChIKey | TWVUEEGPCRICPC-XLRMLUQGSA-N |
| Mol Weight | 452.51 g/mol |
| Molecular Formula | C25H28N2O6 |
| Exact Mass | 452.194737 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IgL6fe6QwZ5 |
|---|---|
| Name | Boc-(S)-3-(Ncp)Ala-OFm |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H28N2O6 |
| InChI | InChI=1S/C25H28N2O6/c1-25(2,3)33-24(29)26-21(12-15-13-22(15)27(30)31)23(28)32-14-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20/h4-11,15,20-22H,12-14H2,1-3H3,(H,26,29)/t15-,21+,22?/m1/s1 |
| InChIKey | TWVUEEGPCRICPC-XLRMLUQGSA-N |
| Molecular Weight | 452.507 g/mol |
| SMILES | N(C(OC(C)(C)C)=O)[C@](C(OCC1c2c(cccc2)-c2c1cccc2)=O)(C[C@]1(C(N(=O)=O)C1)[H])[H] |
| SPLASH | splash10-004i-2900000000-098a9ab23a9ada9daf28 |
| Source of Spectrum | K1-2004-4501-31 |
| Wiley ID | 1561813 |