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exo-11-Dinitrobenzoyloxy-3-oxa-tetracyclo(5.4.0.0.0)undecane
SpectraBase Compound ID 4d3a9DDRtaH
InChI InChI=1S/C17H16N2O7/c20-17(7-3-8(18(21)22)5-9(4-7)19(23)24)26-13-6-11-14-10-1-2-12(14)25-16(11)15(10)13/h3-5,10-16H,1-2,6H2/t10?,11-,12+,13+,14+,15-,16+/m0/s1
InChIKey GBIWMQWQZNRNTL-RPEXIQAESA-N
Mol Weight 360.32 g/mol
Molecular Formula C17H16N2O7
Exact Mass 360.095751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DXqtCxQV4PO
Name exo-11-Dinitrobenzoyloxy-3-oxa-tetracyclo(5.4.0.0.0)undecane
CAS Registry Number 63974-56-1
Comments E.KLEINP
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H16N2O7
InChI InChI=1S/C17H16N2O7/c20-17(7-3-8(18(21)22)5-9(4-7)19(23)24)26-13-6-11-14-10-1-2-12(14)25-16(11)15(10)13/h3-5,10-16H,1-2,6H2/t10?,11-,12+,13+,14+,15-,16+/m0/s1
InChIKey GBIWMQWQZNRNTL-RPEXIQAESA-N
Instrument Name Bruker HX-90
Literature Reference E. Kleinpeter, H. Kuehn, M. Muehlstaedt, Org. Magn. Resonance 9, 90 (1977).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Acetone-D6