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WPADTBWKLHVAEL-CCZLGLOTSA-M
SpectraBase Compound ID 4RZ7bsjXmFm
InChI InChI=1S/C20H30NO3.BrH/c1-3-11-21(2)16-9-10-17(21)13-18(12-16)24-20(23)19(14-22)15-7-5-4-6-8-15;/h4-8,16-19,22H,3,9-14H2,1-2H3;1H/q+1;/p-1/t16-,17+,18-,19?,21+;
InChIKey WPADTBWKLHVAEL-CCZLGLOTSA-M
Mol Weight 412.37 g/mol
Molecular Formula C20H30BrNO3
Exact Mass 411.140907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9EtwdfimK5c
Name WPADTBWKLHVAEL-CCZLGLOTSA-M
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30BrNO3
InChI InChI=1S/C20H30NO3.BrH/c1-3-11-21(2)16-9-10-17(21)13-18(12-16)24-20(23)19(14-22)15-7-5-4-6-8-15;/h4-8,16-19,22H,3,9-14H2,1-2H3;1H/q+1;/p-1/t16-,17+,18-,19?,21+;
InChIKey WPADTBWKLHVAEL-CCZLGLOTSA-M
Literature Reference Author K.H.POOK,W.SCHULZ,R.BANHOLZER
Literature Reference Citation LIEB.ANN.CHEM.,1499(1975)
Molecular Weight 412.367 g/mol
Solvent CD3OD
Source File Reference UWCS12447