CID 5271240

Dtxsid501006248

Structural Information

Molecular Formula

C₁₀H₁₅N₃O₅

SMILES

CC1=C(N=CN1C2C(C(C(O2)CO)O)O)C(=O)N

InChI

InChI=1S/C10H15N3O5/c1-4-6(9(11)17)12-3-13(4)10-8(16)7(15)5(2-14)18-10/h3,5,7-8,10,14-16H,2H2,1H3,(H2,11,17)

InChIKey

BZIPKSSZCBSOFU-UHFFFAOYSA-N

Compound name

1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylimidazole-4-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 257.10117 Da
Monoisotopic Mass: -2.0
XlogP (predicted)

Profile

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]+	258.108446	156.0
[M+Na]+	280.090388	163.6
[M-H]-	256.093894	157.6
[M+NH4]+	275.134993	170.1
[M+K]+	296.064328	162.1
[M+H-H2O]+	240.098430	149.8
[M+HCOO]-	302.099371	172.7
[M+CH3COO]-	316.115021	190.8
[M+Na-2H]-	278.075836	153.8
[M]+	257.10062142	154.6
[M]-	257.10171858	154.6

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.