| SpectraBase Spectrum ID |
CIdXaCfQDG4 |
| Name |
(2R,6S)-6-cyano-5,6-dihydro-3,3-dimethyl-2-(2,3-dimethoxypropyl)-2H,3H-pyran-4-one |
| Alternate Name(s) |
(2S,6R)-6-(2,3-dimethoxypropyl)-5,5-dimethyl-4-oxooxane-2-carbonitrile |
| CAS Registry Number |
129261-32-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H21NO4 |
| InChI |
InChI=1S/C13H21NO4/c1-13(2)11(15)5-9(7-14)18-12(13)6-10(17-4)8-16-3/h9-10,12H,5-6,8H2,1-4H3/t9-,10?,12+/m0/s1 |
| InChIKey |
HYQHICFQEOXZHQ-VXFCFVAISA-N |
| Molecular Weight |
255.314 g/mol |
| SMILES |
C1([C@](O[C@](C#N)(CC1=O)[H])(CC(OC)COC)[H])(C)C |
| SPLASH |
splash10-00di-9310000000-aca88778e1202ed0254c |
| Source of Spectrum |
F-46-1777-32 |
| Wiley ID |
1258754 |
