CID 78358047

1379307-48-8

Structural Information

Molecular Formula
C5H2BrIN2S
SMILES
C1=C(N2C=C(SC2=N1)Br)I
InChI
InChI=1S/C5H2BrIN2S/c6-3-2-9-4(7)1-8-5(9)10-3/h1-2H
InChIKey
IBRNMHJSSNBFEZ-UHFFFAOYSA-N
Compound name
2-bromo-5-iodoimidazo[2,1-b][1,3]thiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

327.81668 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.82396 131.1
[M+Na]+ 350.80590 141.9
[M-H]- 326.80940 131.5
[M+NH4]+ 345.85050 152.0
[M+K]+ 366.77984 137.2
[M+H-H2O]+ 310.81394 129.2
[M+HCOO]- 372.81488 146.1
[M+CH3COO]- 386.83053 144.9
[M+Na-2H]- 348.79135 126.6
[M]+ 327.81613 150.9
[M]- 327.81723 150.9
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.