John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8ODVxju7pfs SpectraBase Spectrum ID=EsR1WvKLZUC

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CESPITULACTAM_H
SpectraBase Compound ID 8ODVxju7pfs
InChI InChI=1S/C21H31NO2/c1-13-6-7-15-8-9-17-19(21(15,3)4)18(22(5)20(17)24)12-14(2)11-16(23)10-13/h11,15-16,18,23H,1,6-10,12H2,2-5H3/b14-11+/t15-,16+,18-/m1/s1
InChIKey FAECNZSNKREOBT-RRXMBOSASA-N
Mol Weight 329.48 g/mol
Molecular Formula C21H31NO2
Exact Mass 329.235479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EsR1WvKLZUC
Name CESPITULACTAM_H
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31NO2
InChI InChI=1S/C21H31NO2/c1-13-6-7-15-8-9-17-19(21(15,3)4)18(22(5)20(17)24)12-14(2)11-16(23)10-13/h11,15-16,18,23H,1,6-10,12H2,2-5H3/b14-11+/t15-,16+,18-/m1/s1
InChIKey FAECNZSNKREOBT-RRXMBOSASA-N
Literature Reference Author Y.C.SHEN,Y.B.CHENG,J.KOBAYASHI,T.KUBOTA,Y.TAKAHASHI,Y.MIKAMI ,J.ITO,Y.S.LIN
Literature Reference Citation J.NAT.PROD.,70,1961(2007)
Literature Reference DOI 10.1021/np078011u
Molecular Weight 329.483 g/mol
Sample ID 31212
Solvent CDCl3
SpectraBase Batch ID 6yPihjOPQPy