| SpectraBase Spectrum ID |
EBbtJgz1j55 |
| Name |
Propanoic acid, 2,2-dimethyl-, 3-hydroxy-2-nitrocyclohexyl ester, [1R-(1.alpha.,2.beta.,3.alpha.)]- |
| CAS Registry Number |
114454-95-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H19NO5 |
| InChI |
InChI=1S/C11H19NO5/c1-11(2,3)10(14)17-8-6-4-5-7(13)9(8)12(15)16/h7-9,13H,4-6H2,1-3H3/t7-,8+,9+/m1/s1 |
| InChIKey |
LBURTHLYGMUPEG-VGMNWLOBSA-N |
| Molecular Weight |
245.275 g/mol |
| SMILES |
O[C@]1([C@](N(=O)=O)([C@@](OC(C(C)(C)C)=O)(CCC1)[H])[H])[H] |
| SPLASH |
splash10-0a4i-9000000000-8f753c53a13ff2d203a4 |
| Source of Spectrum |
H-71-14-0 |
| Synonyms |
(1R,2R,3S)-3-hydroxy-2-nitrocyclohexyl]-pivalat
(1S,2S,3R)-3-hydroxy-2-nitrocyclohexyl pivalate
[(1'R,2'R,3'S)-3'-hydroxy-2'-nitrocyclohexyl][2,2-dimethylpropanoate |
| Wiley ID |
1247830 |
![Propanoic acid, 2,2-dimethyl-, 3-hydroxy-2-nitrocyclohexyl ester, [1R-(1.alpha.,2.beta.,3.alpha.)]-](/api/spectrum/EBbtJgz1j55/structure.png?h=300&w=458 "Propanoic acid, 2,2-dimethyl-, 3-hydroxy-2-nitrocyclohexyl ester, [1R-(1.alpha.,2.beta.,3.alpha.)]-")
