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Periplanone B

Catalog Number ACM61228920
CAS 61228-92-0
Structure {[CurrentData.Name]}
IUPAC Name (1R,2R,5S,6E,10R)-8-Methylidene-5-propan-2-ylspiro[11-oxabicyclo[8.1.0]undec-6-ene-2,2'-oxirane]-3-one
Molecular Weight 248.32
Molecular Formula C15H20O3
Canonical SMILES CC(C)C1CC(=O)C2(CO2)C3C(O3)CC(=C)C=C1
InChI InChI=1S/C15H20O3/c1-9(2)11-5-4-10(3)6-12-14(18-12)15(8-17-15)13(16)7-11/h4-5,9,11-12,14H,3,6-8H2,1-2H3/b5-4+/t11-,12+,14+,15-/m0/s1
InChI Key KVFSFBCTIZBPRK-KGDVWTLMSA-N
Complexity 424
Exact Mass 248.14124450
Heavy Atom Count 18
Monoisotopic Mass 248.14124450
Topological Polar Surface Area 42.1Ų
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