| SpectraBase Spectrum ID |
67J7MIZTZ6O |
| Name |
1-[(Phenylsulfinyl)methyl)-5-[(ethoxycarbonyl)methyl]-6-acetyl-6-azabicyclo[3.2.1]octane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27NO4S |
| InChI |
InChI=1S/C20H27NO4S/c1-3-25-18(23)12-20-11-7-10-19(13-20,14-21(20)16(2)22)15-26(24)17-8-5-4-6-9-17/h4-6,8-9H,3,7,10-15H2,1-2H3/t19-,20+,26?/m1/s1 |
| InChIKey |
HEKWINXRLQWRAU-YJIDZIMYSA-N |
| Molecular Weight |
377.499 g/mol |
| SMILES |
[C@]12(N(C(=O)C)C[C@@](C2)(CS(=O)c2ccccc2)CCC1)CC(=O)OCC |
| SPLASH |
splash10-004i-0009000000-649d743a97210e028ca0 |
| Source of Spectrum |
J-61-4640-37 |
| Synonyms |
ethyl {6-acetyl-1-[(phenylsulfinyl)methyl]-6-azabicyclo[3.2.1]oct-5-yl}acetate |
| Wiley ID |
1358240 |
![1-[(Phenylsulfinyl)methyl)-5-[(ethoxycarbonyl)methyl]-6-acetyl-6-azabicyclo[3.2.1]octane](/api/spectrum/67J7MIZTZ6O/structure.png?h=300&w=458 "1-[(Phenylsulfinyl)methyl)-5-[(ethoxycarbonyl)methyl]-6-acetyl-6-azabicyclo[3.2.1]octane")
