Chem
J-GLOBAL ID：200907049399591740
Nikkaji number：J1.835.212E
(2S,3R)-3-Ethyl-5-methyl-1,2-hexanediol
(2S,3R)-3-エチル-5-メチル-1,2-ヘキサンジオール
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： C9H20O2
Molecular formula furigana： C9-H20-O2
Molecular weight： 160.257
InChI：
InChI=1S/C9H20O2/c1-4-8(5-7(2)3)9(11)6-10/h7-11H,4-6H2,1-3H3/t8-,9-/m1/s1
InChI key：
GTVCRMPAMAKFAI-RKDXNWHRSA-N
SMILES：
CC[C@H](CC(C)C)[C@H](O)CO
Systematic name (3)：
- (2S,3R)-3-エチル-5-メチル-1,2-ヘキサンジオール
- (2S,3R)-3-エチル-5-メチルヘキサン-1,2-ジオール
- (2S,3R)-3-ethyl-5-methylhexane-1,2-diol
- (2S,3R)-3-Ethyl-5-methyl-1,2-hexanediol
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