John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4YJ3w7LC5gh SpectraBase Spectrum ID=1j3jOFlgCCc

(accessed ).
FACNFNFGVJIXDI-UHFFFAOYSA-N
SpectraBase Compound ID 4YJ3w7LC5gh
InChI InChI=1S/C13H21NO5/c1-13(18-7-8-19-13)6-5-12(14(16)17)10-3-2-4-11(15)9-10/h10,12H,2-9H2,1H3
InChIKey FACNFNFGVJIXDI-UHFFFAOYSA-N
Mol Weight 271.31 g/mol
Molecular Formula C13H21NO5
Exact Mass 271.141973 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1j3jOFlgCCc
Name 3-(4,4-ETHYLENDIOXY-1-NITRO-PENT-1-YL)-CYClOHEXAN-1-ONE
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H21NO5
InChI InChI=1S/C13H21NO5/c1-13(18-7-8-19-13)6-5-12(14(16)17)10-3-2-4-11(15)9-10/h10,12H,2-9H2,1H3
InChIKey FACNFNFGVJIXDI-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 271.313 g/mol
Solvent CDCl3
Source File Reference UWKA8
SpectraBase Batch ID 5jKnLBT7So6