| SpectraBase Spectrum ID |
4jkUC7tp4wx |
| Name |
(2rs,4sr)-2-Methoxy-2-methyl-3,4-dihydro-6-phenyl-4-(4'-thienyl)-2H-pyran-5-carbonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.097999963 u |
| Formula |
C18H17NO2S |
| InChI |
InChI=1S/C18H17NO2S/c1-18(20-2)10-15(14-8-9-22-12-14)16(11-19)17(21-18)13-6-4-3-5-7-13/h3-9,12,15H,10H2,1-2H3/t15-,18+/m1/s1 |
| InChIKey |
KYLCAZOLDVKTRF-QAPCUYQASA-N |
| Molecular Weight |
311.399 g/mol |
| SMILES |
C1(=C(O[C@@](C[C@@]1(C1=CSC=C1)[H])(OC)C)C=1C=CC=CC1)C#N |
