HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-2-butenone

HCID 62002
NotesReactions

Completing data — refresh the page later to see the latest

Basic informationNames & identifiersRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
23726-94-5
Standard SMILES
CC=CC(=O)C1C(C)=CCCC1(C)C
InChIKey
CRIGTVCBMUKRSL-UHFFFAOYSA-N
Molecular formula
C13H20O
Average molar mass
192.302 g/mol
Monoisotopic mass
192.15141526

Names & identifiers

Preferred name
1-(2,6,6-Trimethyl-2-cyclohexen-1-yl)-2-butenone
IUPAC
1-(2,6,6-Trimethylcyclohex-2-en-1-yl)but-2-en-1-one

Database identifiers

CAS
23726-94-5、24720-09-0、43052-87-5
PubChem CID
62002
DTXSID
DTXSID0052097
EC Number
245-845-8

Related reactions

2 records
New reaction record
HRID 204163 reaction equation
HRID 204163As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1076795 reaction equation
HRID 1076795As reactantuspto-grants-1976_05

Compound notes

Loading…

On this pageBasic informationNames & identifiersRelated reactionsCompound notes