Spectrum MoNA032528 for URIDINE

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
DRTQHJPVMGBUCF-XVFCMESISA-N
C9H12N2O6
244.06953610399998
O=C1N=C(O)C=CN1C2OC(CO)C(O)C2O
InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1

Mass Spectral Metadata

NameValue
MS2
LC-ESI-QTOF
C9H12N2O6
Agilent qTOF 6545
positive
20 eV
Sonnenburg Lab MS2 Library C18 positive method
Sonnenburg_Lab_qTOF_MS2_Spectra.msp
1.5258888694183772
0.4801331100333555
245.0768121
[M+H]+
2.8317815709324825 ppm
-6.940039999676628E-4 Da