CID 70487

2,4,5,6-tetraaminopyrimidine

Structural Information

Molecular Formula
C4H8N6
SMILES
C1(=C(N=C(N=C1N)N)N)N
InChI
InChI=1S/C4H8N6/c5-1-2(6)9-4(8)10-3(1)7/h5H2,(H6,6,7,8,9,10)
InChIKey
PZRKPUQWIFJRKZ-UHFFFAOYSA-N
Compound name
pyrimidine-2,4,5,6-tetramine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

11762
Patents

140.08104 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.08832 127.1
[M+Na]+ 163.07026 136.4
[M-H]- 139.07376 127.8
[M+NH4]+ 158.11486 144.6
[M+K]+ 179.04420 133.8
[M+H-H2O]+ 123.07830 119.9
[M+HCOO]- 185.07924 152.3
[M+CH3COO]- 199.09489 183.2
[M+Na-2H]- 161.05571 133.0
[M]+ 140.08049 120.6
[M]- 140.08159 120.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe