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4-Hydroxybenzoic acid-isobutyl ester D4 (ring D4)

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For Research Use Only | Not For Clinical Use
CATAPS1219805330
CAS1219805-33-0
Synonyms4-Hydroxybenzoic Acid-isobutyl Ester D4 (Ring D4),4-Hydroxybenzoic acid-isobutyl ester D4 (ring D4)
IUPAC Name2-methylpropyl 2,3,5,6-tetradeuterio-4-hydroxybenzoate
Molecular Weight198.25
Molecular FormulaC112H4H10O3
Canonical SMILES[2H]c1c([2H])c(C(=O)OCC(C)C)c([2H])c([2H])c1O
InChIInChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8,12H,7H2,1-2H3/i3D,4D,5D,6D
Accurate Mass198.1194
FormatNeat
SubcategoryFood additives, flavours and adulterants
TypeStable Isotope Labelled
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