V5B
Summary
Name: | methyl sulfate |
Formula: | C H4 O4 S |
Formal charge: | 0 |
Formula weight: | 112.105 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | methyl hydrogen sulfate |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/CH4O4S/c1-5-6(2,3)4/h1H3,(H,2,3,4) |
InChIKey | InChI | 1.03 | JZMJDSHXVKJFKW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CO[S](O)(=O)=O |
SMILES | CACTVS | 3.385 | CO[S](O)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COS(=O)(=O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | COS(=O)(=O)O |