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Details

Stereochemistry RACEMIC
Molecular Formula C9H16O2
Molecular Weight 156.2221
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-methyloctan-4-olide

SMILES

CCCCC1(C)CCC(=O)O1

InChI

InChIKey=ACJKPCSUVDMEPW-UHFFFAOYSA-N
InChI=1S/C9H16O2/c1-3-4-6-9(2)7-5-8(10)11-9/h3-7H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C9H16O2
Molecular Weight 156.2221
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:22:19 GMT 2023
Edited
by admin
on Sat Dec 16 20:22:19 GMT 2023
Record UNII
N3TAF7HFR2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-methyloctan-4-olide
Systematic Name English
5-Butyldihydro-5-methyl-2(3H)-furanone
Systematic Name English
2(3H)-Furanone,5-butyldihydro-5-methyl-
Systematic Name English
Code System Code Type Description
FDA UNII
N3TAF7HFR2
Created by admin on Sat Dec 16 20:22:19 GMT 2023 , Edited by admin on Sat Dec 16 20:22:19 GMT 2023
PRIMARY
CAS
3285-00-5
Created by admin on Sat Dec 16 20:22:19 GMT 2023 , Edited by admin on Sat Dec 16 20:22:19 GMT 2023
PRIMARY
PUBCHEM
98474
Created by admin on Sat Dec 16 20:22:19 GMT 2023 , Edited by admin on Sat Dec 16 20:22:19 GMT 2023
PRIMARY