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(3S,3aS,6aS)-Tetrahydro-2-benzyl-3-[(4S)-(2,2-dimethyl-1,3-dioxolan-4-yl)]furo[2,3-d]isoxazol-5(2H)-one
SpectraBase Compound ID 1abT34ZU0kU
InChI InChI=1S/C17H21NO5/c1-17(2)20-10-13(22-17)15-16-12(8-14(19)21-16)23-18(15)9-11-6-4-3-5-7-11/h3-7,12-13,15-16H,8-10H2,1-2H3/t12-,13+,15-,16+/m0/s1
InChIKey SZFXIJXMGHVKML-LQKXBSAESA-N
Mol Weight 319.36 g/mol
Molecular Formula C17H21NO5
Exact Mass 319.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Tnsi2AuZNU
Name (3S,3aS,6aS)-Tetrahydro-2-benzyl-3-[(4S)-(2,2-dimethyl-1,3-dioxolan-4-yl)]furo[2,3-d]isoxazol-5(2H)-one
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Formula C17H21NO5
InChI InChI=1S/C17H21NO5/c1-17(2)20-10-13(22-17)15-16-12(8-14(19)21-16)23-18(15)9-11-6-4-3-5-7-11/h3-7,12-13,15-16H,8-10H2,1-2H3/t12-,13+,15-,16+/m0/s1
InChIKey SZFXIJXMGHVKML-LQKXBSAESA-N
Molecular Weight 319.357 g/mol
SMILES [C@@]1(N(O[C@]2(CC(O[C@@]12[H])=O)[H])Cc1ccccc1)([C@@]1(OC(C)(C)OC1)[H])[H]
SPLASH splash10-014i-2094000000-386df60acc734bce934a
Source of Spectrum F-53-11728-5
Synonyms (3S,3aS,6aS)-2-benzyl-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]tetrahydrofuro[2,3-d]isoxazol-5(2H)-one
Wiley ID 803421