(3E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one

CAS Registry Number®

15789-90-9
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CAS Name

(3E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one

Molecular Formula

C14H22O

Molecular Mass

206.32

Cite this Page

(3E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=15789-90-9 (retrieved 2024-08-11) (CAS RN: 15789-90-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C14H22O/c1-10-7-6-8-14(4,5)13(10)9-11(2)12(3)15/h7,9,13H,6,8H2,1-5H3/b11-9+

InChIKey

InChIKey=JRJBVWJSTHECJK-PKNBQFBNNA-N

SMILES

C(=C(/C(C)=O)\C)\C1C(C)(C)CCC=C1C

Canonical SMILES

O=C(C(=CC1C(=CCCC1(C)C)C)C)C

Other Names for this Substance

  • 3-Buten-2-one, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (3E)-
  • 3-Buten-2-one, 3-methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)-
  • (3E)-3-Methyl-4-(2,6,6-trimethyl-2-cyclohexen-1-yl)-3-buten-2-one
  • Isomethyl-α-(E)-ionone
  • (±)-α-Isomethylionone

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Deleted or Replaced CAS Registry Numbers

97306-52-0