![Allyl 3-[4-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]-2-methoxy-5-(2-trimethylsilylethoxycarbonylamino)phenoxy]propanoate](/api/spectrum/3EIwGmQWFk/structure.png?h=300&w=458 "Allyl 3-[4-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]-2-methoxy-5-(2-trimethylsilylethoxycarbonylamino)phenoxy]propanoate")
| SpectraBase Compound ID | DyIwp6hM9vx |
|---|---|
| InChI | InChI=1S/C25H38N2O8Si/c1-6-11-34-23(29)9-12-33-22-16-20(26-25(31)35-13-14-36(3,4)5)19(15-21(22)32-2)24(30)27-10-7-8-18(27)17-28/h6,15-16,18,28H,1,7-14,17H2,2-5H3,(H,26,31)/t18-/m0/s1 |
| InChIKey | NPMRJPRGQVNABR-SFHVURJKSA-N |
| Mol Weight | 522.7 g/mol |
| Molecular Formula | C25H38N2O8Si |
| Exact Mass | 522.239743 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3EIwGmQWFk |
|---|---|
| Name | Allyl 3-[4-[(2S)-2-(hydroxymethyl)pyrrolidine-1-carbonyl]-2-methoxy-5-(2-trimethylsilylethoxycarbonylamino)phenoxy]propanoate |
| Appearance | Brown solid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H38N2O8Si |
| InChI | InChI=1S/C25H38N2O8Si/c1-6-11-34-23(29)9-12-33-22-16-20(26-25(31)35-13-14-36(3,4)5)19(15-21(22)32-2)24(30)27-10-7-8-18(27)17-28/h6,15-16,18,28H,1,7-14,17H2,2-5H3,(H,26,31)/t18-/m0/s1 |
| InChIKey | NPMRJPRGQVNABR-SFHVURJKSA-N |
| Instrument Name | Jeol JMS-DX 303 |
| Ionization Type | EI |
| Molecular Weight | 522.670 g/mol |
| SMILES | N(c1c(C(N2[C@](CO)(CCC2)[H])=O)cc(c(c1)OCCC(OCC=C)=O)OC)C(OCC[Si](C)(C)C)=O |
| SPLASH | splash10-00xs-9526000000-4a1b2871a4634bb252da |
| Source of Spectrum | US7704924B2 |
| Wiley ID | 1842559 |