| SpectraBase Spectrum ID |
FBm3uLHdpjk |
| Name |
2H-1-Benzopyran-3-carbonitrile, 3,4-dihydro-2-methyl-4-oxo-, trans-(.+-.)- |
| Alternate Name(s) |
(2S,3S)-2-methyl-4-oxo-3,4-dihydro-2H-chromene-3-carbonitrile
trans-2,3-dihydro-2-methyl-4-oxo-2H-1-benzopyran-3-carbonitrile |
| CAS Registry Number |
129410-05-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H9NO2 |
| InChI |
InChI=1S/C11H9NO2/c1-7-9(6-12)11(13)8-4-2-3-5-10(8)14-7/h2-5,7,9H,1H3/t7-,9-/m0/s1 |
| InChIKey |
MWCJKEPXGHKZND-CBAPKCEASA-N |
| Molecular Weight |
187.198 g/mol |
| SMILES |
C1([C@]([C@](C)(Oc2c1cccc2)[H])(C#N)[H])=O |
| SPLASH |
splash10-00di-3900000000-17e562b992eb52f8f599 |
| Source of Spectrum |
F-46-3034-31 |
| Wiley ID |
1183860 |
