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(4R,5R)-4,5-Bis(methoxycarbonyl)-2-(2-nitrophenyl)-1,3-dioxolane

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(4R,5R)-4,5-Bis(methoxycarbonyl)-2-(2-nitrophenyl)-1,3-dioxolane
SpectraBase Compound ID Ewj4Dh9GBIS
InChI InChI=1S/C13H13NO8/c1-19-11(15)9-10(12(16)20-2)22-13(21-9)7-5-3-4-6-8(7)14(17)18/h3-6,9-10,13H,1-2H3/t9-,10-/m1/s1
InChIKey FHHHXRVZGCEEQO-NXEZZACHSA-N
Mol Weight 311.25 g/mol
Molecular Formula C13H13NO8
Exact Mass 311.064116 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 731cO2qXTlC
Name (4R,5R)-4,5-bis(Methoxycarbonyl)-2-(2-nitrophenyl)-1,3-dioxolane
Comments Computed using HOSE algorithm
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Exact Mass 311.064116375 u
Formula C13H13NO8
InChI InChI=1S/C13H13NO8/c1-19-11(15)9-10(12(16)20-2)22-13(21-9)7-5-3-4-6-8(7)14(17)18/h3-6,9-10,13H,1-2H3/t9-,10-/m1/s1
InChIKey FHHHXRVZGCEEQO-NXEZZACHSA-N
Molecular Weight 311.246 g/mol
SMILES [C@]1([C@@](OC(O1)C=1C(N(=O)=O)=CC=CC1)(C(=O)OC)[H])(C(=O)OC)[H]