Chem
J-GLOBAL ID：200907037279819609   Nikkaji number：J22.611D

Pear ester

ペアーエステル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H20O2
Molecular formula furigana： C12-H20-O2
Molecular weight： 196.290
InChI： InChI=1S/C12H20O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h8-11H,3-7H2,1-2H3/b9-8-,11-10+
InChI key： OPCRGEVPIBLWAY-QNRZBPGKSA-N
SMILES： CCCCC/C=C\C=C\C(=O)OCC
Systematic name  (3)：
  • (2E,4Z)-2,4-デカジエン酸エチル
  • エチル (2E,4Z)-デカ-2,4-ジエノアート
  • ethyl (2E,4Z)-deca-2,4-dienoate
Other name (3)：
  • ペアーエステル
  • Pear ester
  • (2E,4Z)-2,4-Decadienoic acid ethyl ester
CAS registry number： 3025-30-7
Regulation number (4)：
  • EINECS2211788
  • TSCA(3025-30-7)
  • (2)-798
  • (2)-1085
KEGG COMPOUND： C08486
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