Chem
J-GLOBAL ID：200907008601204585
Nikkaji number：J1.320.446B
4-[(3,7,11-Trimethyl-2,6,10-dodecatrienyl)thio]benzoic acid
4-[(3,7,11-トリメチル-2,6,10-ドデカトリエニル)チオ]安息香酸
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： C22H30O2S
Molecular formula furigana： C22-H30-O2-S
Molecular weight： 358.540
InChI：
InChI=1S/C22H30O2S/c1-17(2)7-5-8-18(3)9-6-10-19(4)15-16-25-21-13-11-20(12-14-21)22(23)24/h7,9,11-15H,5-6,8,10,16H2,1-4H3,(H,23,24)
InChI key：
ZTTKJBBPBNEXNZ-UHFFFAOYSA-N
SMILES：
CC(=CCCC(=CCCC(=CCSc1ccc(cc1)C(=O)O)C)C)C
Systematic name (3)：
- 4-[(3,7,11-トリメチル-2,6,10-ドデカトリエニル)チオ]安息香酸
- 4-[(3,7,11-トリメチルドデカ-2,6,10-トリエン-1-イル)スルファニル]安息香酸
- 4-[(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)sulfanyl]benzoic acid
- 4-[(3,7,11-Trimethyl-2,6,10-dodecatrienyl)thio]benzoic acid
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