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4,5-BENZO-ENDO-1-NITRO-3-OXA-CIS-BICYClO-[4.1.0]-HEPT-4-EN-2-ONE
SpectraBase Compound ID xnJANVAFvo
InChI InChI=1S/C17H11NO5/c19-15(10-6-2-1-3-7-10)14-13-11-8-4-5-9-12(11)23-16(20)17(13,14)18(21)22/h1-9,13-14H/t13-,14-,17+/m1/s1
InChIKey HJCREINBLRVFLF-CPUCHLNUSA-N
Mol Weight 309.28 g/mol
Molecular Formula C17H11NO5
Exact Mass 309.063722 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7jZR8Lu5Es
Name 4,5-BENZO-ENDO-1-NITRO-3-OXA-CIS-BICYClO-[4.1.0]-HEPT-4-EN-2-ONE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H11NO5
InChI InChI=1S/C17H11NO5/c19-15(10-6-2-1-3-7-10)14-13-11-8-4-5-9-12(11)23-16(20)17(13,14)18(21)22/h1-9,13-14H/t13-,14-,17+/m1/s1
InChIKey HJCREINBLRVFLF-CPUCHLNUSA-N
Literature Reference Author N.A.RODIOS,A.BOJILOVA,A.TERZIS,C.P.RAPTOPOULOU
Literature Reference Citation J.HETCYCL.CHEM.,31,1129(1994)
Literature Reference DOI 10.1002/jhet.5570310505
Molecular Weight 309.278 g/mol
Solvent CDCl3
Source File Reference UWCS18968