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Details

Stereochemistry MIXED
Molecular Formula C14H24O
Molecular Weight 208.3398
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-METHYL-4-(2,6,6-TRIMETHYLCYCLOHEX-2-EN-1-YL)BUTANAL

SMILES

CC(CCC1C(C)=CCCC1(C)C)C=O

InChI

InChIKey=VDBFZEMBBKEKPI-UHFFFAOYSA-N
InChI=1S/C14H24O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h6,10-11,13H,5,7-9H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C14H24O
Molecular Weight 208.3398
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 16:21:52 GMT 2025
Edited
by admin
on Tue Apr 01 16:21:52 GMT 2025
Record UNII
T2RHF282JD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-METHYL-4-(2,6,6-TRIMETHYLCYCLOHEX-2-EN-1-YL)BUTANAL
Systematic Name English
2-CETONAL
Preferred Name English
2-CYCLOHEXENE-1-BUTANAL, .ALPHA.,2,6,6-TETRAMETHYL-
Systematic Name English
.ALPHA.,2,6,6-TETRAMETHYL-2-CYCLOHEXENE-1-BUTANAL
Systematic Name English
.ALPHA.,2,6,6-TETRAMETHYL-2-CYCLOHEXENE-1-BUTANAL, (±)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
277-458-5
Created by admin on Tue Apr 01 16:21:52 GMT 2025 , Edited by admin on Tue Apr 01 16:21:52 GMT 2025
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EPA CompTox
DTXSID801358476
Created by admin on Tue Apr 01 16:21:52 GMT 2025 , Edited by admin on Tue Apr 01 16:21:52 GMT 2025
PRIMARY
PUBCHEM
175482
Created by admin on Tue Apr 01 16:21:52 GMT 2025 , Edited by admin on Tue Apr 01 16:21:52 GMT 2025
PRIMARY
FDA UNII
T2RHF282JD
Created by admin on Tue Apr 01 16:21:52 GMT 2025 , Edited by admin on Tue Apr 01 16:21:52 GMT 2025
PRIMARY
CAS
73398-85-3
Created by admin on Tue Apr 01 16:21:52 GMT 2025 , Edited by admin on Tue Apr 01 16:21:52 GMT 2025
PRIMARY