PubChemLite - Uridine 2'-phosphate (C9H13N2O9P)

Structural Information

Molecular Formula

SMILES

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)OP(=O)(O)O

InChI

InChI=1S/C9H13N2O9P/c12-3-4-6(14)7(20-21(16,17)18)8(19-4)11-2-1-5(13)10-9(11)15/h1-2,4,6-8,12,14H,3H2,(H,10,13,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1

InChIKey

HQIDPEYTETUCNF-XVFCMESISA-N

Compound name

[(2R,3R,4R,5R)-2-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate

Related CIDs

2D Structure

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	325.04314	164.1
[M+Na]+	347.02508	171.1
[M-H]-	323.02858	162.2
[M+NH4]+	342.06968	172.7
[M+K]+	362.99902	170.4
[M+H-H2O]+	307.03312	155.3
[M+HCOO]-	369.03406	182.1
[M+CH3COO]-	383.04971	193.7
[M+Na-2H]-	345.01053	164.1
[M]+	324.03531	164.6
[M]-	324.03641	164.6

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

325.04314

164.1

[M+Na]+

347.02508

171.1

[M-H]-

323.02858

162.2

[M+NH4]+

342.06968

172.7

[M+K]+

362.99902

170.4

[M+H-H2O]+

307.03312

155.3

[M+HCOO]-

369.03406

182.1

[M+CH3COO]-

383.04971

193.7

[M+Na-2H]-

345.01053

164.1

[M]+

324.03531

164.6

[M]-

324.03641

164.6

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Uridine 2'-phosphate

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe