John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=J5k6a8k1aJ9 SpectraBase Spectrum ID=1OyFREFwgy4

(accessed ).
6-O-ACETYLCESPITULACTAM_F
SpectraBase Compound ID J5k6a8k1aJ9
InChI InChI=1S/C22H31NO4/c1-13-6-7-16-8-9-18-19(21(16,4)5)22(26,23-20(18)25)12-14(2)11-17(10-13)27-15(3)24/h11,16-17,26H,1,6-10,12H2,2-5H3,(H,23,25)/b14-11+/t16-,17+,22+/m1/s1
InChIKey KNBIBFRADXZBTH-DDDFJRFTSA-N
Mol Weight 373.49 g/mol
Molecular Formula C22H31NO4
Exact Mass 373.225309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1OyFREFwgy4
Name 6-O-ACETYLCESPITULACTAM_F
Compound Number 11
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H31NO4
InChI InChI=1S/C22H31NO4/c1-13-6-7-16-8-9-18-19(21(16,4)5)22(26,23-20(18)25)12-14(2)11-17(10-13)27-15(3)24/h11,16-17,26H,1,6-10,12H2,2-5H3,(H,23,25)/b14-11+/t16-,17+,22+/m1/s1
InChIKey KNBIBFRADXZBTH-DDDFJRFTSA-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 373.492 g/mol
Sample ID 31213
Solvent CDCl3
SpectraBase Batch ID KGuiX42YlGU