| SpectraBase Spectrum ID |
IZODRShmxgf |
| Name |
(1S,2S,5R)-8-((2-Nitrophenyl)sulfonyl)-8-azabicyclo[3.2.1]octan-2-ol |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16N2O5S |
| InChI |
InChI=1S/C13H16N2O5S/c16-12-8-6-9-5-7-10(12)14(9)21(19,20)13-4-2-1-3-11(13)15(17)18/h1-4,9-10,12,16H,5-8H2 |
| InChIKey |
DVPPRKCBPBTSGF-UHFFFAOYSA-N |
| Instrument Name |
Agilent 7890A-5975C |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202000650 |
| Molecular Weight |
312.340 g/mol |
| Optical Rotation |
[a]D20 = +17.6 (c = 0.15, CH2Cl2) |
| Reported Formula |
C13H16N2O5S |
| SMILES |
OC1CCC2N(C1CC2)S(=O)(=O)c1ccccc1[N+](=O)[O-] |
| SPLASH |
splash10-004i-2900000000-63209718fa6655a5ed03 |
| Sample Comments |
87% ee |
| Source of Spectrum |
ACI-59-SM37-2b |
| Thin-Layer Chromatography |
Rf = 0.11 (petroleum ether/CH2Cl2, 1:2, 10% EtOAc) |
| Wiley ID |
1857746 |
![(1S,2S,5R)-8-((2-Nitrophenyl)sulfonyl)-8-azabicyclo[3.2.1]octan-2-ol](/api/spectrum/IZODRShmxgf/structure.png?h=300&w=458 "(1S,2S,5R)-8-((2-Nitrophenyl)sulfonyl)-8-azabicyclo[3.2.1]octan-2-ol")
