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Methyl (3aS*,6R*,7S*,7aR*)-1-oxo-2-phenyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
SpectraBase Compound ID 8MrnIIMICc9
InChI InChI=1S/C16H15NO4/c1-20-15(19)12-11-7-8-16(21-11)9-17(14(18)13(12)16)10-5-3-2-4-6-10/h2-8,11-13H,9H2,1H3/t11-,12-,13+,16-/m1/s1
InChIKey MSPKLVZJFKVONK-NFFDBFGFSA-N
Mol Weight 285.3 g/mol
Molecular Formula C16H15NO4
Exact Mass 285.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfworNQZJnI
Name Methyl (3aS*,6R*,7S*,7aR*)-1-oxo-2-phenyl-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15NO4
InChI InChI=1S/C16H15NO4/c1-20-15(19)12-11-7-8-16(21-11)9-17(14(18)13(12)16)10-5-3-2-4-6-10/h2-8,11-13H,9H2,1H3/t11-,12-,13+,16-/m1/s1
InChIKey MSPKLVZJFKVONK-NFFDBFGFSA-N
Molecular Weight 285.299 g/mol
SMILES [C@@]12(C(N(c3ccccc3)C[C@@]11O[C@@]([C@]2(C(=O)OC)[H])(C=C1)[H])=O)[H]
SPLASH splash10-001i-9400000000-fd88dde2fdaec1467c7a
Source of Spectrum F-67-9155-3c
Wiley ID 1691316