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N(A)-BOC-21-ALPHA-CYANO-DEFORMYL-Z-GEISSOSCHIZINE
SpectraBase Compound ID 5TIKh2pv3ML
InChI InChI=1S/C26H31N3O4/c1-6-17-16(14-23(30)32-5)13-21-24-19(11-12-28(21)22(17)15-27)18-9-7-8-10-20(18)29(24)25(31)33-26(2,3)4/h6-10,16,21-22H,11-14H2,1-5H3/b17-6-/t16-,21+,22-/m1/s1
InChIKey DSQMEDVWAONTSQ-URARMVAGSA-N
Mol Weight 449.55 g/mol
Molecular Formula C26H31N3O4
Exact Mass 449.231456 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AFSBZPDkvql
Name N(A)-BOC-21-ALPHA-CYANO-DEFORMYL-Z-GEISSOSCHIZINE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H31N3O4
InChI InChI=1S/C26H31N3O4/c1-6-17-16(14-23(30)32-5)13-21-24-19(11-12-28(21)22(17)15-27)18-9-7-8-10-20(18)29(24)25(31)33-26(2,3)4/h6-10,16,21-22H,11-14H2,1-5H3/b17-6-/t16-,21+,22-/m1/s1
InChIKey DSQMEDVWAONTSQ-URARMVAGSA-N
Literature Reference Author R.JOKELA,M.HALONEN,M.LOUNASMAA
Literature Reference Citation HETEROCYCLES,38,189(1994)
Literature Reference DOI 10.3987/COM-93-6571
Molecular Weight 449.550 g/mol
Solvent CDCl3