(3E)-3,4,5,6,6-Pentamethyl-3-hepten-2-one

CAS Registry Number®

81786-74-5

CAS Name

(3E)-3,4,5,6,6-Pentamethyl-3-hepten-2-one

Molecular Formula

C12H22O

Molecular Mass

182.30

Cite this Page

(3E)-3,4,5,6,6-Pentamethyl-3-hepten-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81786-74-5 (retrieved 2024-12-23) (CAS RN: 81786-74-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C12H22O/c1-8(9(2)11(4)13)10(3)12(5,6)7/h10H,1-7H3/b9-8+

InChIKey

InChIKey=IXIYWQIFBRZMNR-CMDGGOBGNA-N

SMILES

C(\C(C(C)(C)C)C)(=C(/C(C)=O)\C)/C

Canonical SMILES

O=C(C(=C(C)C(C)C(C)(C)C)C)C

Other Names for this Substance

  • 3-Hepten-2-one, 3,4,5,6,6-pentamethyl-, (3E)-
  • 3-Hepten-2-one, 3,4,5,6,6-pentamethyl-, (E)-
  • (3E)-3,4,5,6,6-Pentamethyl-3-hepten-2-one

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