SpectraBase Spectrum ID |
Atg9W16SF6c |
Name |
2-Isoxazolidinepropanenitrile, 4-cyano-3-phenyl-, cis- |
Alternate Name(s) |
(3S,4R)-2-(2-cyanoethyl)-3-phenyl-4-isoxazolidinecarbonitrile
2-(2-Cyanoethyl)-3-phenyl-4- and 5-cyanoisoxazolidine |
CAS Registry Number |
89902-70-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H13N3O |
InChI |
InChI=1S/C13H13N3O/c14-7-4-8-16-13(12(9-15)10-17-16)11-5-2-1-3-6-11/h1-3,5-6,12-13H,4,8,10H2/t12-,13-/m1/s1 |
InChIKey |
OUPIUPPEMPMIKQ-CHWSQXEVSA-N |
Molecular Weight |
227.267 g/mol |
SMILES |
C1ON([C@@]([C@@]1(C#N)[H])(c1ccccc1)[H])CCC#N |
SPLASH |
splash10-0006-0930000000-a04acae8aaed4772668b |
Source of Spectrum |
KC-1984-53-0 |
Wiley ID |
1228631 |