Chem
J-GLOBAL ID：200907074677589535
Nikkaji number：J479.873B
4-メトキシ-2,3,6-トリメチルベンゼン-1-スルホン酸
4-メトキシ-2,3,6-トリメチルベンゼン-1-スルホン酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C10H14O4S
Molecular formula furigana： C10-H14-O4-S
Molecular weight： 230.280
InChI：
InChI=1S/C10H14O4S/c1-6-5-9(14-4)7(2)8(3)10(6)15(11,12)13/h5H,1-4H3,(H,11,12,13)
InChI key：
JDWREWOCOCHHOO-UHFFFAOYSA-N
SMILES：
COc1cc(C)c(c(C)c1C)S(=O)(=O)O
Systematic name (2)：
- 4-メトキシ-2,3,6-トリメチルベンゼン-1-スルホン酸
- 4-methoxy-2,3,6-trimethylbenzene-1-sulfonic acid
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