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Details

Stereochemistry ACHIRAL
Molecular Formula C5H10OS
Molecular Weight 118.197
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-MERCAPTO-3-METHYLBUTANAL

SMILES

CC(C)(S)CC=O

InChI

InChIKey=WHGAWTZRCJEVHB-UHFFFAOYSA-N
InChI=1S/C5H10OS/c1-5(2,7)3-4-6/h4,7H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H10OS
Molecular Weight 118.197
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Fate of key odorants in Sauternes wines through aging.
2009-09-23
Aroma extraction dilution analysis of Sauternes wines. Key role of polyfunctional thiols.
2006-09-20
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 23:24:19 GMT 2025
Edited
by admin
on Mon Mar 31 23:24:19 GMT 2025
Record UNII
CNZ006442E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-MERCAPTO-3-METHYLBUTANAL
Systematic Name English
3-METHYL-3-SULFANYLBUTANAL
Preferred Name English
BUTANAL, 3-MERCAPTO-3-METHYL-
Systematic Name English
Code System Code Type Description
FDA UNII
CNZ006442E
Created by admin on Mon Mar 31 23:24:19 GMT 2025 , Edited by admin on Mon Mar 31 23:24:19 GMT 2025
PRIMARY
PUBCHEM
527441
Created by admin on Mon Mar 31 23:24:19 GMT 2025 , Edited by admin on Mon Mar 31 23:24:19 GMT 2025
PRIMARY
CAS
308805-43-8
Created by admin on Mon Mar 31 23:24:19 GMT 2025 , Edited by admin on Mon Mar 31 23:24:19 GMT 2025
PRIMARY