3-(METHYLTHIO)-1-HEXANOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C7H16OS
Molecular Weight	148.266
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCC(CCO)SC

InChI

InChIKey=JSASXSHMJYRPCM-UHFFFAOYSA-N

InChI=1S/C7H16OS/c1-3-4-7(9-2)5-6-8/h7-8H,3-6H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H16OS
Molecular Weight	148.266
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

PubMed

Title	Date	PubMed
Optimization of ultrasound assisted-emulsification-dispersive liquid-liquid microextraction by experimental design methodologies for the determination of sulfur compounds in wines by gas chromatography-mass spectrometry.	2010 Dec 17	21094391

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:53:06 GMT 2023` Edited by `admin` on `Fri Dec 15 18:53:06 GMT 2023`
Record UNII	CFU4A74TQT
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(METHYLTHIO)-1-HEXANOL

Systematic Name

English

(±)-3-(METHYLTHIO)-1-HEXANOL

Systematic Name

English

3-METHYLTHIO-1-HEXANOL [FHFI]

Common Name

English

3-(METHYLTHIO)-1-HEXANOL, (±)-

Common Name

English

FEMA NO. 3438

Code

English

3-(METHYLTHIO)HEXAN-1-OL

Systematic Name

English

3-(METHYL THIO) HEXANOL

Systematic Name

English

1-HEXANOL, 3-(METHYLTHIO)-

Systematic Name

English

3-(METHYLTHIO)-1-HEXANOL, (±)-

Systematic Name

English

3-(METHYLMERCAPTO)-1-HEXANOL

Systematic Name

English

Classification Tree Code System Code

JECFA EVALUATION

3-(METHYLTHIO)-1-HEXANOL