Spectrum CCMSLIB00005464326 for CYTIDINE

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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
65-46-3
InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16)/t4-,6-,7-,8-/m1/s1
C9H13N3O5
243.08552051599997
N=C1N=C(O)N(C=C1)C2OC(CO)C(O)C2O
UHDGCWIWMRVCDJ-XVFCMESISA-N

Mass Spectral Metadata

NameValue
ESI
Commercial
Orbitrap
243.086
1
MSV000084495/peak/mzXML/GNPS00006_E10_p.mzXML
MS2
GNPS-MSMLS
Dorrestein, mpanitchpakdi, Kelly Weldon
positive
0.9329566433508593
0.28635021475373723
266.075
[M+Na]+
1.091857558984671 ppm
-2.905160000068463E-4 Da