5-BUTYL-4-METHYLDIHYDRO-2(3H)-FURANONE, TRANS-(+)-

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-(+)-

Structure Search

SMILES

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

InChI

InChIKey=WNVCMFHPRIBNCW-JGVFFNPUSA-N

InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m0/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

PubMed

Title	Date	PubMed
Synthesis and analysis of thio-, thiono-, and dithio-derivatives of whiskey lactone.	2001 Dec	11743786

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 20:18:21 GMT 2023` Edited by `admin` on `Fri Dec 15 20:18:21 GMT 2023`
Record UNII	7A29T3GS95
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-(+)-

Common Name

English

(+)-QUERCUS LACTONE

Common Name

English

2(3H)-FURANONE, 5-BUTYLDIHYDRO-4-METHYL-, (4S,5R)-

Systematic Name

English

(+)-WHISKEY LACTONE

Common Name

English

QUERCUS LACTONE A

Common Name

English

(+)-TRANS-WHISKEY LACTONE

Common Name

English

2(3H)-FURANONE, 5-BUTYLDIHYDRO-4-METHYL-, (4S-TRANS)-

Systematic Name

English

(+)-TRANS-QUERCUS LACTONE

Common Name

English

.BETA.-METHYL-.GAMMA.-OCTALACTONE, TRANS-(3S,4R)-

Common Name

English

(3S,4R)-3-METHYL-4-OCTANOLIDE

Common Name

English

(+)-TRANS-WHISKY LACTONE

Common Name

English

Code System Code Type Description

FDA UNII

7A29T3GS95

Created by admin on Fri Dec 15 20:18:21 GMT 2023 , Edited by admin on Fri Dec 15 20:18:21 GMT 2023

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CAS

80041-01-6

Created by admin on Fri Dec 15 20:18:21 GMT 2023 , Edited by admin on Fri Dec 15 20:18:21 GMT 2023

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EPA CompTox

DTXSID801017484

Created by admin on Fri Dec 15 20:18:21 GMT 2023 , Edited by admin on Fri Dec 15 20:18:21 GMT 2023

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PUBCHEM

11084123

Created by admin on Fri Dec 15 20:18:21 GMT 2023 , Edited by admin on Fri Dec 15 20:18:21 GMT 2023

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