CID 159705

2,4,6-tris(1-aziridinyl)pyrimidine

Structural Information

Molecular Formula
C10H13N5
SMILES
C1CN1C2=CC(=NC(=N2)N3CC3)N4CC4
InChI
InChI=1S/C10H13N5/c1-2-13(1)8-7-9(14-3-4-14)12-10(11-8)15-5-6-15/h7H,1-6H2
InChIKey
QQOSUGWLGFZMHG-UHFFFAOYSA-N
Compound name
2,4,6-tris(aziridin-1-yl)pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.1171 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.12438 203.5
[M+Na]+ 226.10632 208.7
[M-H]- 202.10982 207.1
[M+NH4]+ 221.15092 200.1
[M+K]+ 242.08026 205.3
[M+H-H2O]+ 186.11436 195.1
[M+HCOO]- 248.11530 215.4
[M+CH3COO]- 262.13095 206.1
[M+Na-2H]- 224.09177 200.1
[M]+ 203.11655 204.5
[M]- 203.11765 204.5
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

No patent data available for this compound.