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WHFCDIKITWZGBM-UHFFFAOYSA-N
SpectraBase Compound ID CaWjXYEATbS
InChI InChI=1S/C22H21N5O3/c1-22(2)27-21(29)26(18-11-7-4-8-12-18)20(28)25(27)15-19(30-22)16-13-23-24(14-16)17-9-5-3-6-10-17/h3-14,19H,15H2,1-2H3
InChIKey WHFCDIKITWZGBM-UHFFFAOYSA-N
Mol Weight 403.44 g/mol
Molecular Formula C22H21N5O3
Exact Mass 403.16444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LqI1lLcgUOf
Name WHFCDIKITWZGBM-UHFFFAOYSA-N
Compound Number 635
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21N5O3
InChI InChI=1S/C22H21N5O3/c1-22(2)27-21(29)26(18-11-7-4-8-12-18)20(28)25(27)15-19(30-22)16-13-23-24(14-16)17-9-5-3-6-10-17/h3-14,19H,15H2,1-2H3
InChIKey WHFCDIKITWZGBM-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 403.440 g/mol
Solvent Unknown
Source File Reference UWVP2024