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(+/-)-2,2-DIMETHYL-3-[(3,5-DINITROPHENYL)-CARBAMOYLOXY]-5-NONANONE
SpectraBase Compound ID J18z4q4se8I
InChI InChI=1S/C18H25N3O7/c1-5-6-7-15(22)11-16(18(2,3)4)28-17(23)19-12-8-13(20(24)25)10-14(9-12)21(26)27/h8-10,16H,5-7,11H2,1-4H3,(H,19,23)
InChIKey XKUQVSSBXZZWFZ-UHFFFAOYSA-N
Mol Weight 395.41 g/mol
Molecular Formula C18H25N3O7
Exact Mass 395.16925 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IVcJkyDJaIr
Name (+/-)-2,2-DIMETHYL-3-[(3,5-DINITROPHENYL)-CARBAMOYLOXY]-5-NONANONE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25N3O7
InChI InChI=1S/C18H25N3O7/c1-5-6-7-15(22)11-16(18(2,3)4)28-17(23)19-12-8-13(20(24)25)10-14(9-12)21(26)27/h8-10,16H,5-7,11H2,1-4H3,(H,19,23)
InChIKey XKUQVSSBXZZWFZ-UHFFFAOYSA-N
Literature Reference Author S.E.DENMARK,R.A.STAVENGER,K.T.WONG
Literature Reference Citation J.ORG.CHEM.,63,918(1998)
Literature Reference DOI 10.1021/jo972168h
Molecular Weight 395.412 g/mol
Sample ID 33412
Solvent CDCl3