3,5,5-Trimethyl-4-(3-oxobutyl)-2-cyclohexen-1-one

CAS Registry Number®

74233-41-3

CAS Name

3,5,5-Trimethyl-4-(3-oxobutyl)-2-cyclohexen-1-one

Molecular Formula

C13H20O2

Molecular Mass

208.30

Cite this Page

3,5,5-Trimethyl-4-(3-oxobutyl)-2-cyclohexen-1-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=74233-41-3 (retrieved 2024-12-04) (CAS RN: 74233-41-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H20O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h7,12H,5-6,8H2,1-4H3

InChIKey

InChIKey=GSTVTHMQXVKNQF-UHFFFAOYSA-N

SMILES

CC1(C)C(CCC(C)=O)C(C)=CC(=O)C1

Canonical SMILES

O=C1C=C(C)C(CCC(=O)C)C(C)(C)C1

Other Names for this Substance

  • 2-Cyclohexen-1-one, 3,5,5-trimethyl-4-(3-oxobutyl)-
  • 3,5,5-Trimethyl-4-(3-oxobutyl)-2-cyclohexen-1-one

Deleted or Replaced CAS Registry Numbers

77715-90-3

CAS INSIGHTSTM
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