CID 12295394

2-azidopyrimidine

Structural Information

Molecular Formula
C4H3N5
SMILES
C1=CN=C(N=C1)N=[N+]=[N-]
InChI
InChI=1S/C4H3N5/c5-9-8-4-6-2-1-3-7-4/h1-3H
InChIKey
VMRLCAGRSAPFQE-UHFFFAOYSA-N
Compound name
2-azidopyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

121.03885 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.04613 116.7
[M+Na]+ 144.02807 124.9
[M-H]- 120.03157 120.7
[M+NH4]+ 139.07267 136.3
[M+K]+ 160.00201 119.9
[M+H-H2O]+ 104.03611 113.4
[M+HCOO]- 166.03705 147.2
[M+CH3COO]- 180.05270 171.7
[M+Na-2H]- 142.01352 131.7
[M]+ 121.03830 113.8
[M]- 121.03940 113.8
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