| SpectraBase Spectrum ID |
3ROBzbFq4k9 |
| Name |
2-Octanone, 1-(phenylthio)- |
| Alternate Name(s) |
1-(Phenylsulfanyl)-2-octanone
1-Phenylthio-octan-2-one
1-(Phenylthio)-2-octanone
1-Phenylsulfanyloctan-2-one |
| CAS Registry Number |
71221-50-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20OS |
| InChI |
InChI=1S/C14H20OS/c1-2-3-4-6-9-13(15)12-16-14-10-7-5-8-11-14/h5,7-8,10-11H,2-4,6,9,12H2,1H3 |
| InChIKey |
HCCRWWQWCRGLLI-UHFFFAOYSA-N |
| Molecular Weight |
236.373 g/mol |
| SMILES |
C(Sc1ccccc1)C(=O)CCCCCC |
| SPLASH |
splash10-03di-0920000000-413c68dfde65e6794283 |
| Source of Spectrum |
KC-1979-1085-0 |
| Wiley ID |
1238275 |
