CID 46941643

6-chloro-3-iodo-2-methylimidazo[1,2-b]pyridazine

Structural Information

Molecular Formula
C7H5ClIN3
SMILES
CC1=C(N2C(=N1)C=CC(=N2)Cl)I
InChI
InChI=1S/C7H5ClIN3/c1-4-7(9)12-6(10-4)3-2-5(8)11-12/h2-3H,1H3
InChIKey
NVCVFLNSNUNJIC-UHFFFAOYSA-N
Compound name
6-chloro-3-iodo-2-methylimidazo[1,2-b]pyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

292.92166 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.92894 131.2
[M+Na]+ 315.91088 138.0
[M-H]- 291.91438 125.9
[M+NH4]+ 310.95548 146.6
[M+K]+ 331.88482 139.3
[M+H-H2O]+ 275.91892 121.0
[M+HCOO]- 337.91986 145.0
[M+CH3COO]- 351.93551 141.9
[M+Na-2H]- 313.89633 127.9
[M]+ 292.92111 133.3
[M]- 292.92221 133.3
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