CID 86605233

2-bromo-n-methoxy-n-methylthiazole-4-carboxamide

Structural Information

Molecular Formula
C6H7BrN2O2S
SMILES
CN(C(=O)C1=CSC(=N1)Br)OC
InChI
InChI=1S/C6H7BrN2O2S/c1-9(11-2)5(10)4-3-12-6(7)8-4/h3H,1-2H3
InChIKey
AYKXSQPCHDEZTL-UHFFFAOYSA-N
Compound name
2-bromo-N-methoxy-N-methyl-1,3-thiazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

43
Patents

249.94116 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.94844 137.0
[M+Na]+ 272.93038 137.7
[M+NH4]+ 267.97498 141.3
[M+K]+ 288.90432 139.7
[M-H]- 248.93388 136.5
[M+Na-2H]- 270.91583 138.9
[M]+ 249.94061 135.9
[M]- 249.94171 135.9
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

patents stripe