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9,10-Epoxy-anti-1-hydroxy-1,2-dihydro-endo-dicyclopentadiene-3,5-dinitrobenzoate

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9,10-Epoxy-anti-1-hydroxy-1,2-dihydro-endo-dicyclopentadiene-3,5-dinitrobenzoate
SpectraBase Compound ID JUsGhcsgVFu
InChI InChI=1S/C17H16N2O7/c20-17(7-3-8(18(21)22)5-9(4-7)19(23)24)25-13-2-1-10-11-6-12(14(10)13)16-15(11)26-16/h3-5,10-16H,1-2,6H2
InChIKey FLJHMDWMBGOUGM-UHFFFAOYSA-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 85qM8PohwZI
Name 9,10-Epoxy-anti-1-hydroxy-1,2-dihydro-endo-dicyclopentadiene-3,5-dinitrobenzoate
CAS Registry Number 65471-07-0
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)25-13-2-1-10-11-6-12(14(10)13)16-15(11)26-16/h3-5,10-16H,1-2,6H2
InChIKey FLJHMDWMBGOUGM-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Kleinpeter, H. Kuehn, M. Muehlstaedt, Org. Magn. Resonance 9, 312 (1977).
NMR Standard (CH3)6 Si2O
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3