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SECOBATZELLINE_A_DIACETATE
SpectraBase Compound ID IgjuzRWy3ka
InChI InChI=1S/C14H14ClN3O5/c1-5(19)22-4-8(23-6(2)20)7-3-18-13-9(7)11(16)10(15)12(17)14(13)21/h3,8,16,18H,4,17H2,1-2H3
InChIKey GMJAEOKRMYSQFR-UHFFFAOYSA-N
Mol Weight 339.74 g/mol
Molecular Formula C14H14ClN3O5
Exact Mass 339.062198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5UbYeutss2v
Name SECOBATZELLINE_A_DIACETATE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14ClN3O5
InChI InChI=1S/C14H14ClN3O5/c1-5(19)22-4-8(23-6(2)20)7-3-18-13-9(7)11(16)10(15)12(17)14(13)21/h3,8,16,18H,4,17H2,1-2H3
InChIKey GMJAEOKRMYSQFR-UHFFFAOYSA-N
Literature Reference Author S.P.GUNASEKERA,P.J.MCCARTHY,R.E.LONGLEY,S.A.POMPONI,A.E.WRIG HT
Literature Reference Citation J.NAT.PROD.,62,1208(1999)
Literature Reference DOI 10.1021/np990177a
Molecular Weight 339.735 g/mol
Solvent CD3OD:CDCl3
Source File Reference UWMZ2551