CID 131540231

2-amino-6-chloropyrimidine-4-carbonitrile

Structural Information

Molecular Formula
C5H3ClN4
SMILES
C1=C(N=C(N=C1Cl)N)C#N
InChI
InChI=1S/C5H3ClN4/c6-4-1-3(2-7)9-5(8)10-4/h1H,(H2,8,9,10)
InChIKey
IQZBDTXIXMTLJS-UHFFFAOYSA-N
Compound name
2-amino-6-chloropyrimidine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.00462 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.01190 128.5
[M+Na]+ 176.99384 141.6
[M+NH4]+ 172.03844 133.3
[M+K]+ 192.96778 132.6
[M-H]- 152.99734 122.9
[M+Na-2H]- 174.97929 133.3
[M]+ 154.00407 128.1
[M]- 154.00517 128.1
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.