For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-bromo-1-[(2R,4S,5S)-4-hydroxy-5-methylol-tetrahydrothiophen-2-yl]pyrimidine-2,4-quinone
SpectraBase Compound ID 41tUyWcbps
InChI InChI=1S/C9H11BrN2O4S/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6-,7+/m0/s1
InChIKey PQEKZSRSHRXMOS-LYFYHCNISA-N
Mol Weight 323.16 g/mol
Molecular Formula C9H11BrN2O4S
Exact Mass 321.962291 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID AIpD7JzYgTp
Name 5-bromo-1-[(2R,4S,5S)-4-hydroxy-5-methylol-tetrahydrothiophen-2-yl]pyrimidine-2,4-quinone
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11BrN2O4S
InChI InChI=1S/C9H11BrN2O4S/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6-,7+/m0/s1
InChIKey PQEKZSRSHRXMOS-LYFYHCNISA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2008)
Molecular Weight 323.161 g/mol
Source File Reference MHKO17803