{6-Acetoxy-1-[(3-Methylbutanoyl)Oxy]-6,7A-Dihydro-1H-Spiro[Cyclopenta[c]Pyran-7,2'-Oxiran]-4-Yl}Methyl 3-Methylbutanoate
[CAS# 31078-10-1]

Identification

• Name: {6-Acetoxy-1-[(3-Methylbutanoyl)Oxy]-6,7A-Dihydro-1H-Spiro[Cyclopenta[c]Pyran-7,2'-Oxiran]-4-Yl}Methyl 3-Methylbutanoate
• Synonyms: [1S-(1α,6α,7β,7aα)]-6-acetoxy-6,7a-dihydro-4-[(isovaleryloxy)methyl]spiro[cyclopenta[c]pyran-7(1H),2'-oxiran]-1-yl isovalerate; {(1S,6S,7R,7aS)-6-(acetyloxy)-1-[(3-methylbutanoyl)oxy]-6,7a-dihydro-1H-spiro[cyclopenta[c]pyran-7,2'-oxiran]-4-yl}methyl 3-methylbutanoate
• Molecular Formula: C₂₂H₃₀O₈
• Molecular Weight: 422.47
• CAS Registry Number: 31078-10-1
• EINECS: 250-454-0
• SMILES: O=C(OCC=3/C2=C/C(OC(=O)C)C1(OC1)C2C(OC=3)OC(=O)CC(C)C)CC(C)C
• InChI: 1S/C22H30O8/c1-12(2)6-18(24)26-9-15-10-27-21(30-19(25)7-13(3)4)20-16(15)8-17(29-14(5)23)22(20)11-28-22/h8,10,12-13,17,20-21H,6-7,9,11H2,1-5H3
• InChIKey: XLACUABANMZLCJ-UHFFFAOYSA-N

Properties

• Density: 1.227g/cm³ (Cal.)
• Boiling point: 525.93°C at 760 mmHg (Cal.)
• Flash point: 226.5°C (Cal.)