CID 5271817

Schembl6715086

Structural Information

Molecular Formula
C11H15N3O6
SMILES
CC1=CN(C(=O)C(=N1)C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
InChI
InChI=1S/C11H15N3O6/c1-4-2-14(10(19)6(13-4)9(12)18)11-8(17)7(16)5(3-15)20-11/h2,5,7-8,11,15-17H,3H2,1H3,(H2,12,18)/t5-,7-,8-,11-/m1/s1
InChIKey
GWKWMVLXSSUOFA-IOSLPCCCSA-N
Compound name
4-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-methyl-3-oxopyrazine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

285.0961 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.10338 162.0
[M+Na]+ 308.08532 170.4
[M-H]- 284.08882 163.6
[M+NH4]+ 303.12992 173.3
[M+K]+ 324.05926 168.4
[M+H-H2O]+ 268.09336 154.9
[M+HCOO]- 330.09430 177.9
[M+CH3COO]- 344.10995 197.0
[M+Na-2H]- 306.07077 160.7
[M]+ 285.09555 161.3
[M]- 285.09665 161.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe