| SpectraBase Spectrum ID |
BBjHp5etz3H |
| Name |
2-(phenylthio)-1-cycloheptanone |
| CAS Registry Number |
52190-41-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16OS |
| InChI |
InChI=1S/C13H16OS/c14-12-9-5-2-6-10-13(12)15-11-7-3-1-4-8-11/h1,3-4,7-8,13H,2,5-6,9-10H2 |
| InChIKey |
ZOJRLGACAZEORQ-UHFFFAOYSA-N |
| Molecular Weight |
220.330 g/mol |
| SMILES |
C1(C(CCCCC1)Sc1ccccc1)=O |
| SPLASH |
splash10-0229-0690000000-d448d60d483b45bedd98 |
| Source of Spectrum |
QE-8-925-6 |
| Synonyms |
2-(Phenylthio)cycloheptanone
2-phenylsulfanylcycloheptan-1-one |
| Wiley ID |
1557265 |
