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(3aR,5S,7aS)-6-methyl-5-oxidanyl-3a,4,5,7a-tetrahydro-3H-1-benzofuran-2-one
(3aR,5S,7aS)-6-methyl-5-oxidanyl-3a,4,5,7a-tetrahydro-3H-1-benzofuran-2-one
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC2C(CC1O)CC(=O)O2
Isomeric SMILES
CC1=C[C@@H]2[C@H](C[C@@H]1O)CC(=O)O2
InChI
InChI=1S/C9H12O3/c1-5-2-8-6(3-7(5)10)4-9(11)12-8/h2,6-8,10H,3-4H2,1H3/t6-,7+,8-/m1/s1
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