CID 710579

2-bromo-n-(1,3-thiazol-2-yl)benzamide

Structural Information

Molecular Formula
C10H7BrN2OS
SMILES
C1=CC=C(C(=C1)C(=O)NC2=NC=CS2)Br
InChI
InChI=1S/C10H7BrN2OS/c11-8-4-2-1-3-7(8)9(14)13-10-12-5-6-15-10/h1-6H,(H,12,13,14)
InChIKey
YCZBQJREEOWUPS-UHFFFAOYSA-N
Compound name
2-bromo-N-(1,3-thiazol-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

281.94626 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.95354 145.5
[M+Na]+ 304.93548 157.9
[M-H]- 280.93898 154.4
[M+NH4]+ 299.98008 166.1
[M+K]+ 320.90942 145.9
[M+H-H2O]+ 264.94352 145.0
[M+HCOO]- 326.94446 164.1
[M+CH3COO]- 340.96011 160.7
[M+Na-2H]- 302.92093 150.6
[M]+ 281.94571 165.4
[M]- 281.94681 165.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.