Chem
J-GLOBAL ID:200907071336691367
Nikkaji number:J1.873.452D
(1R)-2β-(2-Bromo-2-propenyl)-2-(acetoxymethyl)-1β-cyclohexanol
(1R)-2β-(2-ブロモ-2-プロペニル)-2-(アセトキシメチル)-1β-シクロヘキサノール
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Substance type:
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
Molecular formula:
C12 H19 BrO3
Molecular formula furigana:
C12-H19-BR-O3
Molecular weight:
291.185
InChI:
InChI=1S/C12H19BrO3/c1-9(13)7-12(8-16-10(2)14)6-4-3-5-11(12)15/h11,15H,1,3-8H2,2H3/t11-,12-/m1/s1
InChI key:
PHXKFDXVICAJMH-VXGBXAGGSA-N
SMILES:
CC(=O)OC[C@]1(CC(=C)Br)CCCC[C@H]1O
Systematic name (3):
(1R)-2β-(2-ブロモ-2-プロペニル)-2-(アセトキシメチル)-1β-シクロヘキサノール
[(1R,2R)-1-(2-ブロモプロパ-2-エン-1-イル)-2-ヒドロキシシクロヘキシル]メチル アセタート
[(1R,2R)-1-(2-bromoprop-2-en-1-yl)-2-hydroxycyclohexyl]methyl acetate
Other name (1):
(1R)-2β-(2-Bromo-2-propenyl)-2-(acetoxymethyl)-1β-cyclohexanol
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