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CHEBI:17760 - methyl sulfate

ChEBI IDCHEBI:17760
ChEBI Namemethyl sulfate
Stars
DefinitionAn alkyl sulfate that is the monomethyl ester of sulfuric acid.
Secondary ChEBI IDsCHEBI:6982, CHEBI:14615, CHEBI:25259
Last Modified7 March 2014
DownloadsMolfile
FormulaCH4O4S
Net Charge0
Average Mass112.106
Monoisotopic Mass111.98303
SMILESCOS(=O)(=O)O
InChIInChI=1S/CH4O4S/c1-5-6(2,3)4/h1H3,(H,2,3,4)
InChIKeyJZMJDSHXVKJFKW-UHFFFAOYSA-N
Wikipedia
ChEBI Ontology
Outgoing Relation(s)
methyl sulfate (CHEBI:17760) is a alkyl sulfate (CHEBI:29281)
methyl sulfate (CHEBI:17760) is a one-carbon compound (CHEBI:64708)
methyl sulfate (CHEBI:17760) is conjugate acid of methyl sulfate(1−) (CHEBI:58261)
Incoming Relation(s)
methyl sulfate(1−) (CHEBI:58261) is conjugate base of methyl sulfate (CHEBI:17760)
IUPAC Name 
methyl hydrogen sulfate
Synonyms  Source
Monomethyl sulfateKEGG COMPOUND
Methyl sulfateKEGG COMPOUND
methyl hydrogen sulfateChEBI
Manual XrefsDatabases
C02704KEGG COMPOUND
C02704KEGG COMPOUND
Methyl_bisulfateWikipedia
CPD-545MetaCyc
Registry NumbersSources
Reaxys:1701229Reaxys
CAS:75-93-4KEGG COMPOUND
CAS:75-93-4ChemIDplus
Citations