| SpectraBase Compound ID | 5o6xVk6DSuH |
|---|---|
| InChI | InChI=1S/C7H4OS2/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H |
| InChIKey | IZTJMBFHQMPFKL-UHFFFAOYSA-N |
| Mol Weight | 168.23 g/mol |
| Molecular Formula | C7H4OS2 |
| Exact Mass | 167.970357 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | InOixmmvC7x |
|---|---|
| Name | 1,3-Benzodithiol-2-one |
| CAS Registry Number | 62576-04-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H4OS2 |
| InChI | InChI=1S/C7H4OS2/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H |
| InChIKey | IZTJMBFHQMPFKL-UHFFFAOYSA-N |
| Molecular Weight | 168.228 g/mol |
| SMILES | C1(Sc2ccccc2S1)=O |
| SPLASH | splash10-00kg-3900000000-06a727d75d5766e4431b |
| Source of Spectrum | J-44-1981-0 |
| Wiley ID | 1163988 |