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3RS-(3R*,3aS*,6aR*)-2,3,6,6a-Tetrahydro-2-phenyl-3-(p-nitrophenyl)furo[3,4-d]isoxazol-4(3aH)-one
SpectraBase Compound ID AzAtI03Pt7O
InChI InChI=1S/C17H14N2O5/c20-17-15-14(10-23-17)24-18(12-4-2-1-3-5-12)16(15)11-6-8-13(9-7-11)19(21)22/h1-9,14-16H,10H2/t14-,15+,16-/m0/s1
InChIKey CNSNSXKQXOVZNW-XHSDSOJGSA-N
Mol Weight 326.31 g/mol
Molecular Formula C17H14N2O5
Exact Mass 326.090272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYvunMxzcEy
Name 3RS-(3R*,3aS*,6aR*)-2,3,6,6a-Tetrahydro-2-phenyl-3-(p-nitrophenyl)furo[3,4-d]isoxazol-4(3aH)-one
Alternate Name(s) (3R,3aS,6aR)-3-(4-nitrophenyl)-2-phenyltetrahydrofuro[3,4-d]isoxazol-4(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O5
InChI InChI=1S/C17H14N2O5/c20-17-15-14(10-23-17)24-18(12-4-2-1-3-5-12)16(15)11-6-8-13(9-7-11)19(21)22/h1-9,14-16H,10H2/t14-,15+,16-/m0/s1
InChIKey CNSNSXKQXOVZNW-XHSDSOJGSA-N
Molecular Weight 326.308 g/mol
SMILES [C@]12(ON([C@]([C@@]1(C(OC2)=O)[H])(c1ccc(N(=O)=O)cc1)[H])c1ccccc1)[H]
SPLASH splash10-0006-9011000000-ce0f5c8145242c1da889
Source of Spectrum F-48-3343-7
Wiley ID 1324635