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SJQPHVHIQSSHAL-YLUTUWDDSA-N

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SJQPHVHIQSSHAL-YLUTUWDDSA-N
SpectraBase Compound ID B8YWHigbNMb
InChI InChI=1S/C19H23N5O6/c1-29-11-4-2-3-10(5-11)6-20-17-13-18(22-8-21-17)24(9-23-13)19-16(28)15(27)14(26)12(7-25)30-19/h2-5,8-9,12,14-16,19,25-28H,6-7H2,1H3,(H,20,21,22)/t12-,14-,15+,16-,19+/m1/s1
InChIKey SJQPHVHIQSSHAL-YLUTUWDDSA-N
Mol Weight 417.42 g/mol
Molecular Formula C19H23N5O6
Exact Mass 417.164833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8D4wCqhmJE4
Name SJQPHVHIQSSHAL-YLUTUWDDSA-N
Compound Number 3F
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23N5O6
InChI InChI=1S/C19H23N5O6/c1-29-11-4-2-3-10(5-11)6-20-17-13-18(22-8-21-17)24(9-23-13)19-16(28)15(27)14(26)12(7-25)30-19/h2-5,8-9,12,14-16,19,25-28H,6-7H2,1H3,(H,20,21,22)/t12-,14-,15+,16-,19+/m1/s1
InChIKey SJQPHVHIQSSHAL-YLUTUWDDSA-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 417.422 g/mol
Solvent DMSO-D6
Source File Reference UWIR16244