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Details

Stereochemistry ACHIRAL
Molecular Formula C11H18O
Molecular Weight 166.26
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-HOMOCYCLOCITRAL

SMILES

CC1=C(CC=O)C(C)(C)CCC1

InChI

InChIKey=VHTFHZGAMYUZEP-UHFFFAOYSA-N
InChI=1S/C11H18O/c1-9-5-4-7-11(2,3)10(9)6-8-12/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H18O
Molecular Weight 166.26
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:03:46 GMT 2023
Edited
by admin
on Fri Dec 15 18:03:46 GMT 2023
Record UNII
CQ51RNO61H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-HOMOCYCLOCITRAL
Common Name English
1-CYCLOHEXENE-1-ACETALDEHYDE, 2,6,6-TRIMETHYL-
Systematic Name English
2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETALDEHYDE [FHFI]
Common Name English
.BETA.-APO-8-CAROTENAL
Common Name English
FEMA NO. 3474
Code English
2,6,6-TRIMETHYL-1-CYCLOHEXENE-1-ACETALDEHYDE
FHFI  
Systematic Name English
HOMOCYCLOCITRAL, .BETA.-
Common Name English
Code System Code Type Description
JECFA MONOGRAPH
911
Created by admin on Fri Dec 15 18:03:46 GMT 2023 , Edited by admin on Fri Dec 15 18:03:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID0047088
Created by admin on Fri Dec 15 18:03:46 GMT 2023 , Edited by admin on Fri Dec 15 18:03:46 GMT 2023
PRIMARY
PUBCHEM
61124
Created by admin on Fri Dec 15 18:03:46 GMT 2023 , Edited by admin on Fri Dec 15 18:03:46 GMT 2023
PRIMARY
CAS
472-66-2
Created by admin on Fri Dec 15 18:03:46 GMT 2023 , Edited by admin on Fri Dec 15 18:03:46 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-454-0
Created by admin on Fri Dec 15 18:03:46 GMT 2023 , Edited by admin on Fri Dec 15 18:03:46 GMT 2023
PRIMARY
FDA UNII
CQ51RNO61H
Created by admin on Fri Dec 15 18:03:46 GMT 2023 , Edited by admin on Fri Dec 15 18:03:46 GMT 2023
PRIMARY