CID 15556995

55921-65-8

Structural Information

Molecular Formula
C8H13N5O
SMILES
C1CCN(C1)C2=NC(=N)N(C(=C2)N)O
InChI
InChI=1S/C8H13N5O/c9-6-5-7(11-8(10)13(6)14)12-3-1-2-4-12/h5,10,14H,1-4,9H2
InChIKey
JOITXEDSRYVTLJ-UHFFFAOYSA-N
Compound name
3-hydroxy-2-imino-6-pyrrolidin-1-ylpyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

34
Patents

195.11201 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.119286 141.6
[M+Na]+ 218.101228 149.6
[M-H]- 194.104734 143.2
[M+NH4]+ 213.145833 157.4
[M+K]+ 234.075168 145.8
[M+H-H2O]+ 178.109270 133.1
[M+HCOO]- 240.110211 162.3
[M+CH3COO]- 254.125861 184.5
[M+Na-2H]- 216.086676 145.5
[M]+ 195.11146142 135.8
[M]- 195.11255858 135.8
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