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Concept information

Preferred term

3-methylbenzylsuccinate(2-)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • -2

formula

  • C12H12O4

inchi

  • InChI=1S/C12H14O4/c1-8-3-2-4-9(5-8)6-10(12(15)16)7-11(13)14/h2-5,10H,6-7H2,1H3,(H,13,14)(H,15,16)/p-2

inchikey

  • OHQFGTDAUDLCBG-UHFFFAOYSA-L

is_conjugate_base_of

mass

  • 220.225

monoisotopicmass

  • 220.07466

smiles

  • CC1=CC(CC(CC([O-])=O)C([O-])=O)=CC=C1

subset

  • 3_STAR

synonym EXACT

  • 2-(3-methylbenzyl)butanedioate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:191236

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