John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=F0dVveyVAZv SpectraBase Spectrum ID=D3IVCXOGbeE

(accessed ).
ISOAAPTAMINE
SpectraBase Compound ID F0dVveyVAZv
InChI InChI=1S/C13H12N2O2/c1-15-6-4-9-11-8(3-5-14-9)7-10(17-2)13(16)12(11)15/h3-7,16H,1-2H3
InChIKey MPBUGSHDXOJPKR-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C13H12N2O2
Exact Mass 228.089878 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D3IVCXOGbeE
Name ISOAAPTAMINE
Compound Number 4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12N2O2
InChI InChI=1S/C13H12N2O2/c1-15-6-4-9-11-8(3-5-14-9)7-10(17-2)13(16)12(11)15/h3-7,16H,1-2H3
InChIKey MPBUGSHDXOJPKR-UHFFFAOYSA-N
Literature Reference Author G.R.PETTIT,H.HOFFMANN,J.MCNULTY,K.C.HIGGS,A.MURPHY,D.J.MOLLO Y,D.L.HERALD,M.D.WIL
Literature Reference Citation J.NAT.PROD.,67,506(2004)
Literature Reference DOI 10.1021/np0204592
Molecular Weight 228.250 g/mol
Solvent DMSO-D6
Source File Reference UWKP4131
SpectraBase Batch ID DoMuA7ktWk