John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=GjLHG259Leg SpectraBase Spectrum ID=2AEqreVuoTF

(accessed ).
1-[2-(1H-PYRROLO-[2.3-B]-PYRIDIN-3-YL)-ETHYL]-PIPERIDINE-4-ETHYLENE_KETAL
SpectraBase Compound ID GjLHG259Leg
InChI InChI=1S/C16H21N3O2/c1-2-14-13(12-18-15(14)17-6-1)3-7-19-8-4-16(5-9-19)20-10-11-21-16/h1-2,6,12H,3-5,7-11H2,(H,17,18)
InChIKey QSEMNTJZARSJHI-UHFFFAOYSA-N
Mol Weight 287.36 g/mol
Molecular Formula C16H21N3O2
Exact Mass 287.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2AEqreVuoTF
Name 1-[2-(1H-PYRROLO-[2.3-B]-PYRIDIN-3-YL)-ETHYL]-PIPERIDINE-4-ETHYLENE_KETAL
Compound Number 10B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21N3O2
InChI InChI=1S/C16H21N3O2/c1-2-14-13(12-18-15(14)17-6-1)3-7-19-8-4-16(5-9-19)20-10-11-21-16/h1-2,6,12H,3-5,7-11H2,(H,17,18)
InChIKey QSEMNTJZARSJHI-UHFFFAOYSA-N
Literature Reference Author Y.BLACHE,M.HICHOUR,O.CHAVIGNON,A.GUEIFFIER,J.C.TEULADE,G.DAU PHIN,J.P.CHAPAT
Literature Reference Citation HETEROCYCLES,45,57(1997)
Literature Reference DOI 10.3987/COM-96-7605
Molecular Weight 287.362 g/mol
Solvent CDCl3
Source File Reference UWMZ2103
SpectraBase Batch ID AeqP6afV8cU