| SpectraBase Spectrum ID |
Ao0fXLT7KoM |
| Name |
[(+-)-2.alpha.,4.alpha.,6.alpha.]-6-[(Acetylamino)methyl]-9-oxo-2-phenyl-1H-perhydroazonine-4-acetic Acid Ethyl Ester |
| Alternate Name(s) |
Ethyl {(2S,4R,6R)-6-[(acetylamino)methyl]-9-oxo-2-phenyloctahydro-1H-azonin-4-yl}acetate |
| CAS Registry Number |
123836-45-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30N2O4 |
| InChI |
InChI=1S/C21H30N2O4/c1-3-27-21(26)13-17-11-16(14-22-15(2)24)9-10-20(25)23-19(12-17)18-7-5-4-6-8-18/h4-8,16-17,19H,3,9-14H2,1-2H3,(H,22,24)(H,23,25)/t16-,17-,19+/m1/s1 |
| InChIKey |
KOMMNRWAUITEJA-LMMKCTJWSA-N |
| Molecular Weight |
374.481 g/mol |
| SMILES |
N1C(CC[C@@](CNC(=O)C)(C[C@](C[C@]1(c1ccccc1)[H])(CC(=O)OCC)[H])[H])=O |
| SPLASH |
splash10-0a4l-4922000000-ab64c634ed345b918450 |
| Source of Spectrum |
C-112-333-30 |
| Wiley ID |
1356683 |
![[(+-)-2.alpha.,4.alpha.,6.alpha.]-6-[(Acetylamino)methyl]-9-oxo-2-phenyl-1H-perhydroazonine-4-acetic Acid Ethyl Ester](/api/spectrum/Ao0fXLT7KoM/structure.png?h=300&w=458 "[(+-)-2.alpha.,4.alpha.,6.alpha.]-6-[(Acetylamino)methyl]-9-oxo-2-phenyl-1H-perhydroazonine-4-acetic Acid Ethyl Ester")
