(3S,3aR)-3-(3-furyl)-3a,7-dimethyl-3,4,5,6-tetrahydroisobenzofuran-1-one
Molecular Formula:
C14H16O3
InChI: InChI=1/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3/t12-,14+/m1/s1
InChIKey: InChIKey=XYYAFLHHHZVPRN-OCCSQVGLBX
SMILES: CC1=C2C(=O)OC(C2(CCC1)C)C3=COC=C3
Names:
(3S,3aR)-3-(3-furyl)-3a,7-dimethyl-3,4,5,6-tetrahydroisobenzofuran-1-one
Registries:
PubChem CID 776138
PubChem ID 8212556
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