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Concept information

Preferred term

2,2-dimethyl-4-pentenoic acid  

Type

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

charge

  • 0

formula

  • C7H12O2

inchi

  • InChI=1S/C7H12O2/c1-4-5-7(2,3)6(8)9/h4H,1,5H2,2-3H3,(H,8,9)

inchikey

  • BGUAPYRHJPWVEM-UHFFFAOYSA-N

mass

  • 128.171

monoisotopicmass

  • 128.08373

smiles

  • OC(=O)C(CC=C)(C)C

subset

  • 2_STAR

synonym EXACT

  • 2,2-dimethylpent-4-enoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:179475

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