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BENZOSIMULINE
SpectraBase Compound ID 7E78az7lMXm
InChI InChI=1S/C20H19NO2/c1-12-9-10-15-14(11-12)17-18(23-20(15,2)3)13-7-5-6-8-16(13)21(4)19(17)22/h5-11H,1-4H3
InChIKey OSBHLKXCNYMURI-UHFFFAOYSA-N
Mol Weight 305.38 g/mol
Molecular Formula C20H19NO2
Exact Mass 305.141579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9WUEy6qvJ7n
Name BENZOSIMULINE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19NO2
InChI InChI=1S/C20H19NO2/c1-12-9-10-15-14(11-12)17-18(23-20(15,2)3)13-7-5-6-8-16(13)21(4)19(17)22/h5-11H,1-4H3
InChIKey OSBHLKXCNYMURI-UHFFFAOYSA-N
Literature Reference Author I.S.CHEN,I.W.TSAI,C.M.TENG,J.J.CHEN,Y.L.CHANG,F.N.KO,M.C.LU, J.M.PEZZUTO
Literature Reference Citation PHYTOCHEM.,46,525(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00280-x
Molecular Weight 305.376 g/mol
Sample ID 52603
Solvent CDCl3