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Concept information

Preferred term

4,4-dimethyl-2e-pentenoic acid  

Type

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

charge

  • 0

formula

  • C7H12O2

inchi

  • InChI=1S/C7H12O2/c1-7(2,3)5-4-6(8)9/h4-5H,1-3H3,(H,8,9)/b5-4+

inchikey

  • RPVPMVHPERYZNF-SNAWJCMRSA-N

mass

  • 128.171

monoisotopicmass

  • 128.08373

smiles

  • OC(=O)/C=C/C(C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (E)-4,4-dimethylpent-2-enoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:179474

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