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4-caranol, 3,5-dinitrobenzoate
SpectraBase Compound ID 3NLfuhVcnpW
InChI InChI=1S/C17H20N2O6/c1-9-4-13-14(17(13,2)3)8-15(9)25-16(20)10-5-11(18(21)22)7-12(6-10)19(23)24/h5-7,9,13-15H,4,8H2,1-3H3/t9-,13+,14-,15-/s2
InChIKey MVXVPBWNLRDWSF-HILGNYEYSA-N
Mol Weight 348.36 g/mol
Molecular Formula C17H20N2O6
Exact Mass 348.132136 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KDuIr7urHCs
Name 4-caranol, 3,5-dinitrobenzoate
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Formula C17H20N2O6
InChI InChI=1S/C17H20N2O6/c1-9-4-13-14(17(13,2)3)8-15(9)25-16(20)10-5-11(18(21)22)7-12(6-10)19(23)24/h5-7,9,13-15H,4,8H2,1-3H3/t9-,13+,14-,15-/s2
InChIKey MVXVPBWNLRDWSF-HILGNYEYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 61813M
Solvent CDCl3