CID 6481042

5-bromo-2-hydroxy-n-thiazol-5-yl-benzamide

Structural Information

Molecular Formula
C10H7BrN2O2S
SMILES
C1=CC(=C(C=C1Br)C(=O)NC2=CN=CS2)O
InChI
InChI=1S/C10H7BrN2O2S/c11-6-1-2-8(14)7(3-6)10(15)13-9-4-12-5-16-9/h1-5,14H,(H,13,15)
InChIKey
IKPVKYAWYGDWKH-UHFFFAOYSA-N
Compound name
5-bromo-2-hydroxy-N-(1,3-thiazol-5-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

297.94116 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.94844 148.5
[M+Na]+ 320.93038 160.9
[M-H]- 296.93388 156.2
[M+NH4]+ 315.97498 167.8
[M+K]+ 336.90432 148.4
[M+H-H2O]+ 280.93842 148.0
[M+HCOO]- 342.93936 165.8
[M+CH3COO]- 356.95501 194.0
[M+Na-2H]- 318.91583 152.7
[M]+ 297.94061 168.2
[M]- 297.94171 168.2
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.