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3-CHLORO,ENDO-6,SYN-7-DIIODOBICYCLO-[3.1.1]-HEPT-3-ENE-2-YL-4-NITROBENZOATE
SpectraBase Compound ID C2WgUrpGFl1
InChI InChI=1S/C14H10ClI2NO4/c15-9-5-8-11(16)10(12(8)17)13(9)22-14(19)6-1-3-7(4-2-6)18(20)21/h1-5,8,10-13H/t8-,10+,11+,12-,13?
InChIKey ABEKHNVJEOMIJF-AMOFPOLASA-N
Mol Weight 545.5 g/mol
Molecular Formula C14H10ClI2NO4
Exact Mass 544.838776 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ESTlJAqxKVw
Name 3-CHLORO,ENDO-6,SYN-7-DIIODOBICYCLO-[3.1.1]-HEPT-3-ENE-2-YL-4-NITROBENZOATE
CAS Registry Number 102870-44-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10ClI2NO4
InChI InChI=1S/C14H10ClI2NO4/c15-9-5-8-11(16)10(12(8)17)13(9)22-14(19)6-1-3-7(4-2-6)18(20)21/h1-5,8,10-13H/t8-,10+,11+,12-,13?
InChIKey ABEKHNVJEOMIJF-AMOFPOLASA-N
Literature Reference Author C.HERZOG,R.LANG,D.BRUECKNER,P.KEMMER,M.CHRISTL
Literature Reference Citation CHEM.BER.,119,3027(1986)
Literature Reference DOI 10.1002/cber.19861191011
Molecular Weight 545.500 g/mol
Solvent CDCl3
Source File Reference UWGB1561