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trans-3-Methyl-4-decanolide

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trans-3-Methyl-4-decanolide

(4R,5S)-trans-3-Methyl-4-decanolide

(4S,5R)-trans-3-Methyl-4-decanolide
Names
IUPAC names (4R,5S)-5-Hexyl-4-methyldihydrofuran-2(3H)-one
(4S,5R)-5-Hexyl-4-methyldihydrofuran-2(3H)-one
Identifiers
CAS Number
3D model (JSmol)
ChemSpider
PubChem CID
UNII
CompTox Dashboard (EPA)
InChI
  • InChI=1S/C11H20O2/c1-3-4-5-6-7-10-9(2)8-11(12)13-10/h9-10H,3-8H2,1-2H3/t9-,10+/m0/s1Key: XNRLAEXLQFIKEY-VHSXEESVSA-N
  • (4R,5S): InChI=1S/C11H20O2/c1-3-4-5-6-7-10-9(2)8-11(12)13-10/h9-10H,3-8H2,1-2H3/t9-,10+/m1/s1Key: XNRLAEXLQFIKEY-ZJUUUORDSA-N
SMILES
  • (4R,5S): C1(CCCCCC)OC(C1)=O
  • (4S,5R): C1(CCCCCC)OC(C1)=O
Properties
Chemical formula C11H20O2
Molar mass 184.279 g·mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Chemical compound

trans-3-Methyl-4-decanolide is a chemical compound with formula C
11H
20O
2, found in clary sage, in the juice of the blood orange, and in the extract of mandarin peel. It is a lactone with coconut-like odor.

The cis isomer is found in an African orchid.

See also

References

  1. B. Maurer and A. Mauser (1983), New constituents of clary sage oil. IXth Int. Congr. Essent. Oils, Book 3, pages 69-76
  2. ^ Regula Naef and Alain Velluz (2005). "Identification of trans-3-Methyl-4-Decanolide in Blood Orange Juice and Mandarin Peel". Journal of Essential Oil Research.
  3. R. Kaiser (1993), The Scent of Orchids,page 191. Elsevier


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