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4-[(3,5-DINITROPHENYL)-CARBAMOYLOXY]-4-PHENYL-2-BUTANONE
SpectraBase Compound ID 3JNJ6frP5M4
InChI InChI=1S/C17H15N3O7/c1-11(21)7-16(12-5-3-2-4-6-12)27-17(22)18-13-8-14(19(23)24)10-15(9-13)20(25)26/h2-6,8-10,16H,7H2,1H3,(H,18,22)
InChIKey AZLIWPSUPLWQGR-UHFFFAOYSA-N
Mol Weight 373.32 g/mol
Molecular Formula C17H15N3O7
Exact Mass 373.091 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KO7zREe0mTH
Name 4-[(3,5-DINITROPHENYL)-CARBAMOYLOXY]-4-PHENYL-2-BUTANONE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15N3O7
InChI InChI=1S/C17H15N3O7/c1-11(21)7-16(12-5-3-2-4-6-12)27-17(22)18-13-8-14(19(23)24)10-15(9-13)20(25)26/h2-6,8-10,16H,7H2,1H3,(H,18,22)
InChIKey AZLIWPSUPLWQGR-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 373.322 g/mol
Sample ID 33410
Solvent CDCl3