![2-(benzyloxycarbonylamino)-5-[bis(tert-butoxycarbonylamino)methyleneamino]-2-(trifluoromethyl)valeric acid methyl ester](/api/spectrum/EtJc82REqkI/structure.png?h=300&w=458 "2-(benzyloxycarbonylamino)-5-[bis(tert-butoxycarbonylamino)methyleneamino]-2-(trifluoromethyl)valeric acid methyl ester")
| SpectraBase Compound ID | 7LKwP5oVhGA |
|---|---|
| InChI | InChI=1S/C26H37F3N4O8/c1-23(2,3)40-20(35)31-19(32-21(36)41-24(4,5)6)30-15-11-14-25(18(34)38-7,26(27,28)29)33-22(37)39-16-17-12-9-8-10-13-17/h8-10,12-13H,11,14-16H2,1-7H3,(H,33,37)(H2,30,31,32,35,36) |
| InChIKey | LGAMNCAPTABQQA-UHFFFAOYSA-N |
| Mol Weight | 590.6 g/mol |
| Molecular Formula | C26H37F3N4O8 |
| Exact Mass | 590.256349 g/mol |
19F Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EtJc82REqkI |
|---|---|
| Name | 2-(benzyloxycarbonylamino)-5-[bis(tert-butoxycarbonylamino)methyleneamino]-2-(trifluoromethyl)valeric acid methyl ester |
| Compound Number | 7A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H37F3N4O8 |
| InChI | InChI=1S/C26H37F3N4O8/c1-23(2,3)40-20(35)31-19(32-21(36)41-24(4,5)6)30-15-11-14-25(18(34)38-7,26(27,28)29)33-22(37)39-16-17-12-9-8-10-13-17/h8-10,12-13H,11,14-16H2,1-7H3,(H,33,37)(H2,30,31,32,35,36) |
| InChIKey | LGAMNCAPTABQQA-UHFFFAOYSA-N |
| Literature Reference Author | M.MORONI,B.KOKSCH,S.N.OSIPOV,M.CRUCIANELLI,M.FRIGERIO,P.BRAV O,K.BURGER |
| Literature Reference Citation | J.ORG.CHEM.,66,130(2001) |
| Literature Reference DOI | 10.1021/jo0009043 |
| Solvent | CDCl3 |
| Source File Reference | UWMS28108 |