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(5S,7R)-7-METHYL-5-(4-NITROPHENYL)-7,8-DIHYDRO-5H-[1,3]-DIOXOLO-[4,5-G]-ISOCHROMENE
SpectraBase Compound ID AXgNlSZRKhV
InChI InChI=1S/C17H15NO5/c1-10-6-12-7-15-16(22-9-21-15)8-14(12)17(23-10)11-2-4-13(5-3-11)18(19)20/h2-5,7-8,10,17H,6,9H2,1H3/t10-,17+/m1/s1
InChIKey XVECGJYZWCEIOK-QGHHPUGFSA-N
Mol Weight 313.31 g/mol
Molecular Formula C17H15NO5
Exact Mass 313.095023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 875DWFSUcK7
Name (5S,7R)-7-METHYL-5-(4-NITROPHENYL)-7,8-DIHYDRO-5H-[1,3]-DIOXOLO-[4,5-G]-ISOCHROMENE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15NO5
InChI InChI=1S/C17H15NO5/c1-10-6-12-7-15-16(22-9-21-15)8-14(12)17(23-10)11-2-4-13(5-3-11)18(19)20/h2-5,7-8,10,17H,6,9H2,1H3/t10-,17+/m1/s1
InChIKey XVECGJYZWCEIOK-QGHHPUGFSA-N
Literature Reference Author R.C.SIMON,E.BUSTO,N.RICHTER,F.BELAJ,W.KROUTIL
Literature Reference Citation EUR.J.ORG.CHEM.,2014,111(2014)
Literature Reference DOI 10.1002/ejoc.201301429
Molecular Weight 313.310 g/mol
Solvent CDCl3
Source File Reference UWIR18128