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(3R,3aS,6aS)-Tetrahydro-6a-(ethoxycarbonyl)-3-phenyl-1-(phenylmethyl)-1H,6H-furo[3,4-c]isoxazol-6-one
SpectraBase Compound ID FIh6061j5v4
InChI InChI=1S/C21H21NO5/c1-2-25-19(23)21-17(14-26-20(21)24)18(16-11-7-4-8-12-16)27-22(21)13-15-9-5-3-6-10-15/h3-12,17-18H,2,13-14H2,1H3/t17-,18-,21-/m0/s1
InChIKey UPTODUKLXJWSAA-WFXMLNOXSA-N
Mol Weight 367.4 g/mol
Molecular Formula C21H21NO5
Exact Mass 367.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JHJyRGp0evh
Name (3R,3aS,6aS)-Tetrahydro-6a-(ethoxycarbonyl)-3-phenyl-1-(phenylmethyl)-1H,6H-furo[3,4-c]isoxazol-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO5
InChI InChI=1S/C21H21NO5/c1-2-25-19(23)21-17(14-26-20(21)24)18(16-11-7-4-8-12-16)27-22(21)13-15-9-5-3-6-10-15/h3-12,17-18H,2,13-14H2,1H3/t17-,18-,21-/m0/s1
InChIKey UPTODUKLXJWSAA-WFXMLNOXSA-N
Molecular Weight 367.401 g/mol
SMILES [C@@]12(N(O[C@]([C@@]2(COC1=O)[H])(c1ccccc1)[H])Cc1ccccc1)C(=O)OCC
SPLASH splash10-00kf-9206000000-de168b0ab5edc8c970c4
Source of Spectrum F-51-125-8
Synonyms (3R*,3aR*,6aS*)-Tetrahydro-6a-(ethoxycarbonyl)-3-phenyl-1-(phenylmethyl)-1H,6H-furo[3,4-c]isoxazol-6-one Ethyl (3R,3aS,6aS)-1-benzyl-6-oxo-3-phenyldihydro-1H,3H-furo[3,4-c]isoxazole-6a(6H)-carboxylate
Wiley ID 790482