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: 19
Patents: 195.11201 Da
Monoisotopic Mass: 0.9
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]+	196.11929	141.2
[M+Na]+	218.10123	151.0
[M+NH4]+	213.14583	147.4
[M+K]+	234.07517	148.7
[M-H]-	194.10473	142.7
[M+Na-2H]-	216.08668	146.4
[M]+	195.11146	142.5
[M]-	195.11256	142.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe