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IGMXDFIRNKLWBU-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

IGMXDFIRNKLWBU-UHFFFAOYSA-N
SpectraBase Compound ID AtbpW7hJKac
InChI InChI=1S/C21H23N5O3/c1-2-3-8-20(28)29-14-19(27)22-13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)21-23-25-26-24-21/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,22,27)(H,23,24,25,26)
InChIKey IGMXDFIRNKLWBU-UHFFFAOYSA-N
Mol Weight 393.45 g/mol
Molecular Formula C21H23N5O3
Exact Mass 393.18009 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID T0WPlw86Wz
Name IGMXDFIRNKLWBU-UHFFFAOYSA-N
Compound Number DEGRADATE-#2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H23N5O3
InChI InChI=1S/C21H23N5O3/c1-2-3-8-20(28)29-14-19(27)22-13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)21-23-25-26-24-21/h4-7,9-12H,2-3,8,13-14H2,1H3,(H,22,27)(H,23,24,25,26)
InChIKey IGMXDFIRNKLWBU-UHFFFAOYSA-N
Literature Reference Author R.A.SEBURG,J.M.BALLARD,T.L.HWANG,C.M.SULLIVAN
Literature Reference Citation J.PHARM.BIOM.ANAL.,42,411(2006)
Literature Reference DOI 10.1016/j.jpba.2006.04.030
Molecular Weight 393.445 g/mol
Solvent CD3CN
Source File Reference UWDB62