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5-[1-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-URACIL-5-YL_METHYLENE]-3-PHENYL-2-THIOHYDANTOIN
SpectraBase Compound ID DvdmdvviZPf
InChI InChI=1S/C19H18N4O6S/c24-9-14-13(25)7-15(29-14)22-8-10(16(26)21-18(22)28)6-12-17(27)23(19(30)20-12)11-4-2-1-3-5-11/h1-6,8,13-15,24-25H,7,9H2,(H,20,30)(H,21,26,28)/b12-6-/t13-,14+,15+/m1/s1
InChIKey YATJTXSIVMMDDH-OKGZOPMDSA-N
Mol Weight 430.44 g/mol
Molecular Formula C19H18N4O6S
Exact Mass 430.094705 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 88Ss2HomL27
Name 5-[1-(2-DEOXY-BETA-D-ERYTHRO-PENTOFURANOSYL)-URACIL-5-YL_METHYLENE]-3-PHENYL-2-THIOHYDANTOIN
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18N4O6S
InChI InChI=1S/C19H18N4O6S/c24-9-14-13(25)7-15(29-14)22-8-10(16(26)21-18(22)28)6-12-17(27)23(19(30)20-12)11-4-2-1-3-5-11/h1-6,8,13-15,24-25H,7,9H2,(H,20,30)(H,21,26,28)/b12-6-/t13-,14+,15+/m1/s1
InChIKey YATJTXSIVMMDDH-OKGZOPMDSA-N
Literature Reference Author A.A.EL-BARBARY,A.I.KHODAIR,E.B.PEDERSEN,C.NIELSEN
Literature Reference Citation MH.CHEM.,125,593(1994)
Literature Reference DOI 10.1007/BF00811853
Molecular Weight 430.435 g/mol
Solvent DMSO-D6
Source File Reference UWSK1089