Chem
J-GLOBAL ID：200907017528814778
Nikkaji number：J16.618I
Chalcogran
カルコグラン
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： C9H16O2
Molecular formula furigana： C9-H16-O2
Molecular weight： 156.225
InChI：
InChI=1S/C9H16O2/c1-2-8-4-6-9(11-8)5-3-7-10-9/h8H,2-7H2,1H3
InChI key：
DCWKALWZHORJAO-UHFFFAOYSA-N
SMILES：
CCC1CCC2(CCCO2)O1
Systematic name (3)：
- 2-エチル-1,6-ジオキサスピロ[4.4]ノナン
- 7-エチル-1,6-ジオキサスピロ[4.4]ノナン
- 2-ethyl-1,6-dioxaspiro[4.4]nonane
- カルコグラン
- Chalcogran
- 2-Ethyl-1,6-dioxaspiro[4.4]nonane
- 7-Ethyl-1,6-dioxaspiro[4.4]nonane
KEGG COMPOUND：
C08471
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