Chem
J-GLOBAL ID:201707021320405858
Nikkaji number:J3.636.259F
Acetic acid [(3aS,6aR)-6-isopropoxy-2-oxo-6a-trifluoromethyl-2,3,3a,6a-tetrahydro-4H-cyclopenta[b]furan-5-yl] ester
酢酸[(3aS,6aR)-6-イソプロポキシ-2-オキソ-6a-トリフルオロメチル-2,3,3a,6a-テトラヒドロ-4H-シクロペンタ[b]フラン-5-イル]
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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:
C13 H15 F3 O5
Molecular formula furigana:
C13-H15-F3-O5
Molecular weight:
308.253
InChI:
InChI=1S/C13H15F3O5/c1-6(2)19-11-9(20-7(3)17)4-8-5-10(18)21-12(8,11)13(14,15)16/h6,8H,4-5H2,1-3H3/t8-,12+/m0/s1
InChI key:
XIPYHOCTIZQMHK-QPUJVOFHSA-N
SMILES:
CC(C)OC1=C(C[C@H]2CC(=O)O[C@@]12C(F)(F)F)OC(=O)C
Systematic name (3):
酢酸[(3aS,6aR)-6-イソプロポキシ-2-オキソ-6a-トリフルオロメチル-2,3,3a,6a-テトラヒドロ-4H-シクロペンタ[b]フラン-5-イル]
(3aS,6aR)-2-オキソ-6-(プロパン-2-イルオキシ)-6a-(トリフルオロメチル)-2H,3H,3aH,4H,6aH-シクロペンタ[b]フラン-5-イル アセタート
(3aS,6aR)-2-oxo-6-(propan-2-yloxy)-6a-(trifluoromethyl)-2H,3H,3aH,4H,6aH-cyclopenta[b]furan-5-yl acetate
Other name (1):
Acetic acid [(3aS,6aR)-6-isopropoxy-2-oxo-6a-trifluoromethyl-2,3,3a,6a-tetrahydro-4H-cyclopenta[b]furan-5-yl] ester
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