CID 46864159

8-chloro-3-iodoimidazo[1,2-a]pyrazine

Structural Information

Molecular Formula
C6H3ClIN3
SMILES
C1=CN2C(=CN=C2C(=N1)Cl)I
InChI
InChI=1S/C6H3ClIN3/c7-5-6-10-3-4(8)11(6)2-1-9-5/h1-3H
InChIKey
RHQCTVNTDPLROD-UHFFFAOYSA-N
Compound name
8-chloro-3-iodoimidazo[1,2-a]pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

278.906 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.913276 126.7
[M+Na]+ 301.895218 133.0
[M-H]- 277.898724 121.2
[M+NH4]+ 296.939823 142.4
[M+K]+ 317.869158 134.6
[M+H-H2O]+ 261.903260 116.4
[M+HCOO]- 323.904201 140.9
[M+CH3COO]- 337.919851 137.5
[M+Na-2H]- 299.880666 124.6
[M]+ 278.90545142 128.1
[M]- 278.90654858 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

patents stripe