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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H16O2
Molecular Weight 156.2221
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-BUTYL-4-METHYLDIHYDRO-2(3H)-FURANONE, TRANS-(-)-

SMILES

CCCC[C@@H]1OC(=O)C[C@H]1C

InChI

InChIKey=WNVCMFHPRIBNCW-SFYZADRCSA-N
InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1

HIDE SMILES / InChI

Molecular Formula C9H16O2
Molecular Weight 156.2221
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 20:18:20 GMT 2023
Edited
by admin
on Fri Dec 15 20:18:20 GMT 2023
Record UNII
9OQS29SV9M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-BUTYL-4-METHYLDIHYDRO-2(3H)-FURANONE, TRANS-(-)-
Systematic Name English
FEMA NO. 3803, TRANS-(-)-
Code English
(-)-TRANS-WHISKY LACTONE
Common Name English
(-)-TRANS-WHISKEY LACTONE
Common Name English
(-)-TRANS-QUERCUS LACTONE
Common Name English
.BETA.-METHYL-.GAMMA.-OCTALACTONE, TRANS-(3R,4S)-
Common Name English
2(3H)-FURANONE, 5-BUTYLDIHYDRO-4-METHYL-, (4R-TRANS)-
Systematic Name English
2(3H)-FURANONE, 5-BUTYLDIHYDRO-4-METHYL-, (4R,5S)-
Systematic Name English
Code System Code Type Description
CAS
105119-22-0
Created by admin on Fri Dec 15 20:18:20 GMT 2023 , Edited by admin on Fri Dec 15 20:18:20 GMT 2023
PRIMARY
PUBCHEM
11105597
Created by admin on Fri Dec 15 20:18:20 GMT 2023 , Edited by admin on Fri Dec 15 20:18:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID20146959
Created by admin on Fri Dec 15 20:18:20 GMT 2023 , Edited by admin on Fri Dec 15 20:18:20 GMT 2023
PRIMARY
FDA UNII
9OQS29SV9M
Created by admin on Fri Dec 15 20:18:20 GMT 2023 , Edited by admin on Fri Dec 15 20:18:20 GMT 2023
PRIMARY