CID 75357444

6-bromo-8-methylimidazo[1,2-a]pyridine-2-carbothioamide

Structural Information

Molecular Formula
C9H8BrN3S
SMILES
CC1=CC(=CN2C1=NC(=C2)C(=S)N)Br
InChI
InChI=1S/C9H8BrN3S/c1-5-2-6(10)3-13-4-7(8(11)14)12-9(5)13/h2-4H,1H3,(H2,11,14)
InChIKey
IMWSZEJEZJRRIQ-UHFFFAOYSA-N
Compound name
6-bromo-8-methylimidazo[1,2-a]pyridine-2-carbothioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.96222 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.96950 141.2
[M+Na]+ 291.95144 156.7
[M-H]- 267.95494 147.0
[M+NH4]+ 286.99604 162.6
[M+K]+ 307.92538 143.7
[M+H-H2O]+ 251.95948 141.3
[M+HCOO]- 313.96042 157.8
[M+CH3COO]- 327.97607 156.9
[M+Na-2H]- 289.93689 146.1
[M]+ 268.96167 162.4
[M]- 268.96277 162.4
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.