CID 924606

Benzamide, 4-bromo-n-(4,5-dihydro-2-thiazolyl)-

Structural Information

Molecular Formula
C10H9BrN2OS
SMILES
C1CSC(=N1)NC(=O)C2=CC=C(C=C2)Br
InChI
InChI=1S/C10H9BrN2OS/c11-8-3-1-7(2-4-8)9(14)13-10-12-5-6-15-10/h1-4H,5-6H2,(H,12,13,14)
InChIKey
VSOYURKABNGYPK-UHFFFAOYSA-N
Compound name
4-bromo-N-(4,5-dihydro-1,3-thiazol-2-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

283.9619 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.96918 147.4
[M+Na]+ 306.95112 159.0
[M-H]- 282.95462 155.9
[M+NH4]+ 301.99572 167.9
[M+K]+ 322.92506 147.1
[M+H-H2O]+ 266.95916 146.9
[M+HCOO]- 328.96010 164.7
[M+CH3COO]- 342.97575 162.1
[M+Na-2H]- 304.93657 151.6
[M]+ 283.96135 165.9
[M]- 283.96245 165.9
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