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(3ARS,4RS,9BRS)-3-(4-ACETOXY-2-BUTYNYL)-2,3,3A,4,5,9B-HEXAHYDRO-1H-4,9B-[2]-PROPENOPYRROLO-[2,3-C]-QUINOLIN-10-ONE
SpectraBase Compound ID KzbLpUVCVKQ
InChI InChI=1S/C20H20N2O3/c1-14(23)25-13-5-4-11-22-12-10-20-15-6-2-3-7-16(15)21-17(19(20)22)8-9-18(20)24/h2-3,6-9,17,19,21H,10-13H2,1H3/t17-,19-,20+/m1/s1
InChIKey YFHZMHFCQPHWNB-RLLQIKCJSA-N
Mol Weight 336.39 g/mol
Molecular Formula C20H20N2O3
Exact Mass 336.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7KNelDqi3A9
Name (3ARS,4RS,9BRS)-3-(4-ACETOXY-2-BUTYNYL)-2,3,3A,4,5,9B-HEXAHYDRO-1H-4,9B-[2]-PROPENOPYRROLO-[2,3-C]-QUINOLIN-10-ONE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20N2O3
InChI InChI=1S/C20H20N2O3/c1-14(23)25-13-5-4-11-22-12-10-20-15-6-2-3-7-16(15)21-17(19(20)22)8-9-18(20)24/h2-3,6-9,17,19,21H,10-13H2,1H3/t17-,19-,20+/m1/s1
InChIKey YFHZMHFCQPHWNB-RLLQIKCJSA-N
Literature Reference Author D.SOLE,S.GARCIA-RUBIO,L.VALLVERDU,J.BONJOCH
Literature Reference Citation J.ORG.CHEM.,66,5266(2001)
Literature Reference DOI 10.1021/jo015659h
Molecular Weight 336.390 g/mol
Solvent CDCl3
Source File Reference UWLU27233