CID 745462

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

Structural Information

Molecular Formula
C10H7IN2OS
SMILES
C1=CC=C(C(=C1)C(=O)NC2=NC=CS2)I
InChI
InChI=1S/C10H7IN2OS/c11-8-4-2-1-3-7(8)9(14)13-10-12-5-6-15-10/h1-6H,(H,12,13,14)
InChIKey
GWKLGSXFAURWML-UHFFFAOYSA-N
Compound name
2-iodo-N-(1,3-thiazol-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.93237 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.93965 156.2
[M+Na]+ 352.92159 157.7
[M-H]- 328.92509 155.0
[M+NH4]+ 347.96619 170.2
[M+K]+ 368.89553 159.9
[M+H-H2O]+ 312.92963 145.4
[M+HCOO]- 374.93057 171.5
[M+CH3COO]- 388.94622 194.6
[M+Na-2H]- 350.90704 147.0
[M]+ 329.93182 154.6
[M]- 329.93292 154.6
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.