CID 69368455

7-bromo-[1,2]thiazolo[4,5-b]pyridine

Structural Information

Molecular Formula
C6H3BrN2S
SMILES
C1=CN=C2C=NSC2=C1Br
InChI
InChI=1S/C6H3BrN2S/c7-4-1-2-8-5-3-9-10-6(4)5/h1-3H
InChIKey
VBIKPIQSWKTYMN-UHFFFAOYSA-N
Compound name
7-bromo-[1,2]thiazolo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

213.92003 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.92731 123.9
[M+Na]+ 236.90925 140.4
[M-H]- 212.91275 130.3
[M+NH4]+ 231.95385 147.9
[M+K]+ 252.88319 129.3
[M+H-H2O]+ 196.91729 125.1
[M+HCOO]- 258.91823 142.4
[M+CH3COO]- 272.93388 141.4
[M+Na-2H]- 234.89470 133.1
[M]+ 213.91948 146.4
[M]- 213.92058 146.4
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.