Record Information
public_id FDB011118
Chemical Information
name 2-Methylthiophene
description Maillard product; present in roast beef and coffee aromas
cas_number 554-14-3
Properties
created_at 2010-04-08 22:09:28
updated_at 2013-08-28 07:39:38
moldb_smiles CC1=CC=CS1
moldb_formula C5H6S
moldb_average_mass 98.166
moldb_inchi InChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-4H,1H3
moldb_mono_mass 98.019020882
moldb_inchikey InChIKey=XQQBUAPQHNYYRS-UHFFFAOYSA-N
moldb_iupac 2-methylthiophene
Structure Thumb
Synonyms
Synonym Source
2-Methylthiacyclopentadiene biospider
a-Thiotolene db_source