| SpectraBase Spectrum ID |
4cVdLYoOsTz |
| Name |
2-methyl-4-(methylthio)-5,6-dihydro-[1]benzoxepino[5,4-b]pyridine-3-carbonitrile |
| CAS Registry Number |
130445-88-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14N2OS |
| InChI |
InChI=1S/C16H14N2OS/c1-10-13(9-17)16(20-2)12-7-8-19-14-6-4-3-5-11(14)15(12)18-10/h3-6H,7-8H2,1-2H3 |
| InChIKey |
ARHWTPSYPVXAPI-UHFFFAOYSA-N |
| Molecular Weight |
282.361 g/mol |
| SMILES |
c-12nc(C)c(c(c2CCOc2c1cccc2)SC)C#N |
| SPLASH |
splash10-0159-0090000000-15fc9dacfcf8092d6138 |
| Source of Spectrum |
F-46-3712-11 |
| Wiley ID |
1285893 |
![2-methyl-4-(methylthio)-5,6-dihydro-[1]benzoxepino[5,4-b]pyridine-3-carbonitrile](/api/spectrum/4cVdLYoOsTz/structure.png?h=300&w=458 "2-methyl-4-(methylthio)-5,6-dihydro-[1]benzoxepino[5,4-b]pyridine-3-carbonitrile")
