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3-(1-NITRO-4-OXO-PENT-1-YL)-CYClOHEXAN-1-ONE
SpectraBase Compound ID Fb7ePTIab6S
InChI InChI=1S/C11H17NO4/c1-8(13)5-6-11(12(15)16)9-3-2-4-10(14)7-9/h9,11H,2-7H2,1H3
InChIKey KRNSDFFTNCOATI-UHFFFAOYSA-N
Mol Weight 227.26 g/mol
Molecular Formula C11H17NO4
Exact Mass 227.115758 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3fDPFETncN
Name 3-(1-NITRO-4-OXO-PENT-1-YL)-CYClOHEXAN-1-ONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H17NO4
InChI InChI=1S/C11H17NO4/c1-8(13)5-6-11(12(15)16)9-3-2-4-10(14)7-9/h9,11H,2-7H2,1H3
InChIKey KRNSDFFTNCOATI-UHFFFAOYSA-N
Literature Reference Author J.HALASZ,G.TOTH,I.KADAS,G.ARVAI,K.MIKLO,R.HAESSNER
Literature Reference Citation MH.CHEM.,126,1011(1995)
Literature Reference DOI 10.1007/BF00811021
Molecular Weight 227.260 g/mol
Solvent CDCl3
Source File Reference UWKA9