2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione

CAS Registry Number®

110979-06-1

CAS Name

2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione

Molecular Formula

C22H34O5

Molecular Mass

378.50

Cite this Page

2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=110979-06-1 (retrieved 2024-10-31) (CAS RN: 110979-06-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H34O5/c1-4-5-6-7-8-9-10-11-12-13-20(27-17(2)23)15-18-14-19(24)16-21(26-3)22(18)25/h14,16,20H,4-13,15H2,1-3H3/t20-/m1/s1

InChIKey

InChIKey=JIUGZSYPFREDLG-HXUWFJFHSA-N

SMILES

C([C@@H](CCCCCCCCCCC)OC(C)=O)C=1C(=O)C(OC)=CC(=O)C1

Canonical SMILES

O=C1C=C(OC)C(=O)C(=C1)CC(OC(=O)C)CCCCCCCCCCC

Other Names for this Substance

  • 2,5-Cyclohexadiene-1,4-dione, 2-[(2R)-2-(acetyloxy)tridecyl]-6-methoxy-
  • 2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione
  • (-)-Cornudentanone
  • Cornudentanone

CAS INSIGHTSTM
Adam Sanford and Orr Ravitz from CAS