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3-(4-NITROPHENYL)-3A,4,11,11A-TETRAHYDROISOXAZOLO[5,4-C]-1,6-BENZODIOXOCINE

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3-(4-NITROPHENYL)-3A,4,11,11A-TETRAHYDROISOXAZOLO[5,4-C]-1,6-BENZODIOXOCINE
SpectraBase Compound ID LCPTVyT5PmT
InChI InChI=1S/C17H14N2O5/c20-19(21)12-7-5-11(6-8-12)17-13-9-22-14-3-1-2-4-15(14)23-10-16(13)24-18-17/h1-8,13,16H,9-10H2/t13-,16+/m1/s1
InChIKey CPRLUFHKCWPYHR-CJNGLKHVSA-N
Mol Weight 326.31 g/mol
Molecular Formula C17H14N2O5
Exact Mass 326.090272 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1HfFBlyokGa
Name 3-(4-NITROPHENYL)-3A,4,11,11A-TETRAHYDROISOXAZOLO[5,4-C]-1,6-BENZODIOXOCINE
Comments =
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H14N2O5
InChI InChI=1S/C17H14N2O5/c20-19(21)12-7-5-11(6-8-12)17-13-9-22-14-3-1-2-4-15(14)23-10-16(13)24-18-17/h1-8,13,16H,9-10H2/t13-,16+/m1/s1
InChIKey CPRLUFHKCWPYHR-CJNGLKHVSA-N
Instrument Name Tesla BS487
Literature Reference L.FISERA, L.JAROSKOVA, W.SCHROTH, M.GABLER, P.ORAVEC (1988)Coll.Czech.Chem.Comm.: v.53, N5, 1060-1067.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo