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CHEBI:235427 - Ring-(13)C6 Propylparaben

ChEBI IDCHEBI:235427
ChEBI NameRing-(13)C6 Propylparaben
Stars
Submitterjhunter
DownloadsMolfile
FormulaC4[13C6]H12O3
Net Charge0
Average Mass186.157
Monoisotopic Mass186.09877
SMILESCCCOC(=O)[13c]1[13cH][13cH][13c](O)[13cH][13cH]1
InChIInChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3/i3+1,4+1,5+1,6+1,8+1,9+1
InChIKeyQELSKZZBTMNZEB-CICUYXHZSA-N
ChEBI Ontology
Outgoing Relation(s)
Ring-(13)C6 Propylparaben (CHEBI:235427) is a 4-hydroxybenzoate ester (CHEBI:79323)