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

*Links on SpectraBase are not permalinks.
5'-Thymidylic acid, 3-methyl-3'-o-methyl-, dimethyl ester
SpectraBase Compound ID BIqIL4YPred
InChI InChI=1S/C14H23N2O8P/c1-9-7-16(14(18)15(2)13(9)17)12-6-10(20-3)11(24-12)8-23-25(19,21-4)22-5/h7,10-12H,6,8H2,1-5H3/t10-,11+,12+/m0/s1
InChIKey WWRQCGVFTVVWTI-QJPTWQEYSA-N
Mol Weight 378.32 g/mol
Molecular Formula C14H23N2O8P
Exact Mass 378.119203 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 7tr8BTgGHMe
Name 5'-Thymidylic acid, 3-methyl-3'-O-methyl-, dimethyl ester
CAS Registry Number 67690-05-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23N2O8P
InChI InChI=1S/C14H23N2O8P/c1-9-7-16(14(18)15(2)13(9)17)12-6-10(20-3)11(24-12)8-23-25(19,21-4)22-5/h7,10-12H,6,8H2,1-5H3/t10-,11+,12+/m0/s1
InChIKey WWRQCGVFTVVWTI-QJPTWQEYSA-N
Molecular Weight 378.318 g/mol
SMILES C1(N(C=C(C(N1C)=O)C)[C@@]1(O[C@](COP(=O)(OC)OC)([C@](C1)(OC)[H])[H])[H])=O
SPLASH splash10-053r-7390000000-c208b75e80abe2835378
Source of Spectrum KO-5-156-5
Synonyms Tetramethyl-5'-thymidylic acid [(2R,3S,5R)-5-(3,5-dimethyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3-methoxyoxolan-2-yl]methyl dimethyl phosphate
Wiley ID 1358481