CID 13279

5-methyl-2'-deoxy cytidine

Structural Information

Molecular Formula
C10H15N3O4
SMILES
CC1=CN(C(=O)N=C1N)[C@H]2CC([C@H](O2)CO)O
InChI
InChI=1S/C10H15N3O4/c1-5-3-13(10(16)12-9(5)11)8-2-6(15)7(4-14)17-8/h3,6-8,14-15H,2,4H2,1H3,(H2,11,12,16)/t6?,7-,8-/m1/s1
InChIKey
LUCHPKXVUGJYGU-SPDVFEMOSA-N
Compound name
4-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

220
References

8202
Patents

241.10626 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11354 153.1
[M+Na]+ 264.09548 163.1
[M+NH4]+ 259.14008 158.2
[M+K]+ 280.06942 162.3
[M-H]- 240.09898 154.7
[M+Na-2H]- 262.08093 155.5
[M]+ 241.10571 154.5
[M]- 241.10681 154.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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