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YBBLKDTWFYVDSP-YYZLIPTLSA-N

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YBBLKDTWFYVDSP-YYZLIPTLSA-N
SpectraBase Compound ID L4YDt1rHGLf
InChI InChI=1S/C18H21N5O6/c24-6-11-13(26)14(27)15(28)18(29-11)23-8-22-12-16(20-7-21-17(12)23)19-5-9-1-3-10(25)4-2-9/h1-4,7-8,11,13-15,18,24-28H,5-6H2,(H,19,20,21)/t11-,13-,14+,15-,18+/m1/s1
InChIKey YBBLKDTWFYVDSP-YYZLIPTLSA-N
Mol Weight 403.4 g/mol
Molecular Formula C18H21N5O6
Exact Mass 403.149183 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5szjgAEKMma
Name YBBLKDTWFYVDSP-YYZLIPTLSA-N
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21N5O6
InChI InChI=1S/C18H21N5O6/c24-6-11-13(26)14(27)15(28)18(29-11)23-8-22-12-16(20-7-21-17(12)23)19-5-9-1-3-10(25)4-2-9/h1-4,7-8,11,13-15,18,24-28H,5-6H2,(H,19,20,21)/t11-,13-,14+,15-,18+/m1/s1
InChIKey YBBLKDTWFYVDSP-YYZLIPTLSA-N
Literature Reference Author J.VICHA,M.MALON,P.VESELA,O.HUMPA,M.STRNAD,R.MAREK
Literature Reference Citation MAGN.RES.CHEM.,48,318(2010)
Literature Reference DOI 10.1002/mrc.2575
Molecular Weight 403.395 g/mol
Solvent DMSO-D6
Source File Reference UWIR16242