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5'-Deoxy-5',6-bis-(1,3-diphenylimidazolidin-2-yl)uridine
SpectraBase Compound ID DWnDNRXKmwO
InChI InChI=1S/C39H40N6O5/c46-33-25-31(37-43(29-17-9-3-10-18-29)23-24-44(37)30-19-11-4-12-20-30)45(39(49)40-33)38-36(48)35(47)32(50-38)26-34-41(27-13-5-1-6-14-27)21-22-42(34)28-15-7-2-8-16-28/h1-20,25,32,34-38,47-48H,21-24,26H2,(H,40,46,49)/t32-,35-,36-,38-/m1/s1
InChIKey RINYHXNDIORUAN-INDKZRMMSA-N
Mol Weight 672.8 g/mol
Molecular Formula C39H40N6O5
Exact Mass 672.306018 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzUGgBvsb96
Name 5'-Deoxy-5',6-bis-(1,3-diphenylimidazolidin-2-yl)uridine
Appearance Pink powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 672.306018407 u
Formula C39H40N6O5
InChI InChI=1S/C39H40N6O5/c46-33-25-31(37-43(29-17-9-3-10-18-29)23-24-44(37)30-19-11-4-12-20-30)45(39(49)40-33)38-36(48)35(47)32(50-38)26-34-41(27-13-5-1-6-14-27)21-22-42(34)28-15-7-2-8-16-28/h1-20,25,32,34-38,47-48H,21-24,26H2,(H,40,46,49)/t32-,35-,36-,38-/m1/s1
InChIKey RINYHXNDIORUAN-INDKZRMMSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0001.105
Molecular Weight 672.786 g/mol
SMILES N1C(C=C(N([C@@]2(O[C@@]([C@]([C@]2(O)[H])(O)[H])(CC2N(CCN2C2=CC=CC=C2)C2=CC=CC=C2)[H])[H])C1=O)C1N(CCN1C1=CC=CC=C1)C1=CC=CC=C1)=O
SPLASH splash10-00di-0092000000-bce6886c769a38ca3df7
Source of Spectrum ARK-2000-31-11 (DOI: 10.3998/ark.5550190.0001.105)
Wiley ID 1908453