| SpectraBase Spectrum ID |
G9l9zase5Ud |
| Name |
Sodium 2-benzyl-trans-7-cyano-cis-2-azabicyclo[4.2.0]octane-6-carboxylate |
| Alternate Name(s) |
sodium (1S,6S,7R)-2-benzyl-7-cyano-2-azabicyclo[4.2.0]octane-6-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17N2NaO2 |
| InChI |
InChI=1S/C16H18N2O2.Na/c17-10-13-9-14-16(13,15(19)20)7-4-8-18(14)11-12-5-2-1-3-6-12;/h1-3,5-6,13-14H,4,7-9,11H2,(H,19,20);/q;+1/p-1/t13-,14-,16-;/m0./s1 |
| InChIKey |
MISBDDWZLWESHL-LRRYJFTCSA-M |
| Molecular Weight |
292.314 g/mol |
| SMILES |
[Na+].[C@]12([C@](N(Cc3ccccc3)CCC1)([H])C[C@]2(C#N)[H])C([O-])=O |
| SPLASH |
splash10-00kf-9140000000-4a34437e4507a91dc75d |
| Source of Spectrum |
KC-1992-2037-14 |
| Wiley ID |
776716 |
![Sodium 2-benzyl-trans-7-cyano-cis-2-azabicyclo[4.2.0]octane-6-carboxylate](/api/spectrum/G9l9zase5Ud/structure.png?h=300&w=458 "Sodium 2-benzyl-trans-7-cyano-cis-2-azabicyclo[4.2.0]octane-6-carboxylate")
