John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=lZbMyl3bdE SpectraBase Spectrum ID=27TgZb8iXpn

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N(B)-METHYLVOACHALOTINE
SpectraBase Compound ID lZbMyl3bdE
InChI InChI=1S/C23H29N2O3/c1-5-14-12-25(3)19-11-17(14)23(13-26,22(27)28-4)20(25)10-16-15-8-6-7-9-18(15)24(2)21(16)19/h5-9,17,19-20,26H,10-13H2,1-4H3/q+1/b14-5-/t17-,19+,20-,23-,25+/m1/s1
InChIKey PGVBVTSHOSHPGS-MUAXYCBWSA-N
Mol Weight 381.5 g/mol
Molecular Formula C23H29N2O3
Exact Mass 381.217818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 27TgZb8iXpn
Name N(B)-METHYLVOACHALOTINE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H29N2O3
InChI InChI=1S/C23H29N2O3/c1-5-14-12-25(3)19-11-17(14)23(13-26,22(27)28-4)20(25)10-16-15-8-6-7-9-18(15)24(2)21(16)19/h5-9,17,19-20,26H,10-13H2,1-4H3/q+1/b14-5-/t17-,19+,20-,23-,25+/m1/s1
InChIKey PGVBVTSHOSHPGS-MUAXYCBWSA-N
Literature Reference Author W.L.B.MEDEIROS,I.J.C.VIEIRA,L.MATHIAS,R.BRAZ-FILHO,J.SCHRIPS EMA
Literature Reference Citation J.BRAZ.CHEM.SOC.,12,368(2001)
Literature Reference DOI 10.1590/s0103-50532001000300008
Molecular Weight 381.495 g/mol
Solvent DMSO-D6
Source File Reference UWPA1350
SpectraBase Batch ID Bi3CkOjUQ38