| SpectraBase Spectrum ID |
1PJHZeQVxQZ |
| Name |
3-(5-Methyl-thiophen-2-yl)-cycloheptanone |
| Alternate Name(s) |
3-(5-Methylthiophen-2-yl)cycloheptanone
3-(5-Methyl-2-thiophenyl)-1-cycloheptanone
3-(5-Methylthiophen-2-yl)cycloheptan-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H16OS |
| InChI |
InChI=1S/C12H16OS/c1-9-6-7-12(14-9)10-4-2-3-5-11(13)8-10/h6-7,10H,2-5,8H2,1H3 |
| InChIKey |
CIKBYMMLJPWTHU-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1021/ol702302y |
| Molecular Weight |
208.319 g/mol |
| SMILES |
c1c(C2CCCCC(C2)=O)sc(c1)C |
| SPLASH |
splash10-0pi0-0930000000-92185e31b47d41c43d6e |
| Source of Spectrum |
A1-9-5195/SMS10-5b' |
| Wiley ID |
1758824 |
