| SpectraBase Spectrum ID |
CNi0jhyuaAP |
| Name |
(rac)-Benzyl (2S,3aR,4S,7aS)-4-((tert-butoxycarbonyl)amino)-2-(furan-2-yl)-2,3,3a,4,5,7a-hexahydro-1H-indole-1-carboxylate |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H30N2O5 |
| InChI |
InChI=1S/C25H30N2O5/c1-25(2,3)32-23(28)26-19-11-7-12-20-18(19)15-21(22-13-8-14-30-22)27(20)24(29)31-16-17-9-5-4-6-10-17/h4-10,12-14,18-21H,11,15-16H2,1-3H3,(H,26,28)/t18-,19+,20+,21+/m1/s1 |
| InChIKey |
XUXIILAQKJRTTM-ANULTFPQSA-N |
| Instrument Name |
Finnigan MAT 90 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201501199 |
| Molecular Weight |
438.524 g/mol |
| Quality |
98 |
| Reported Formula |
C25H30N2O5 |
| SMILES |
N([C@]1(CC=C[C@]2([C@@]1(C[C@](N2C(=O)OCC1=CC=CC=C1)(C1=CC=CO1)[H])[H])[H])[H])C(=O)OC(C)(C)C |
| SPLASH |
splash10-0007-9273100000-3d62f0286d8021c2ad43 |
| Source of Spectrum |
QE-21-SM11-19 (DOI: 10.1002/chem.201501199) |
| Thin-Layer Chromatography |
0.37 (cHex/EtOAc, 3:1) |
| Wiley ID |
1906889 |
![Benzyl (2S,3aR,4S,7aS)-4-[(tert-Butoxycarbonyl)amino]-2-(furan-2-yl)-2,3,3a,4,5,7a-hexahydro-1H-indole-1-carboxylate](/api/spectrum/CNi0jhyuaAP/structure.png?h=300&w=458 "Benzyl (2S,3aR,4S,7aS)-4-[(tert-Butoxycarbonyl)amino]-2-(furan-2-yl)-2,3,3a,4,5,7a-hexahydro-1H-indole-1-carboxylate")
