CID 14711358

N-(4-chlorophenyl)-n-(4-formyl-1,3-thiazol-2-yl)acetamide

Structural Information

Molecular Formula
C12H9ClN2O2S
SMILES
CC(=O)N(C1=CC=C(C=C1)Cl)C2=NC(=CS2)C=O
InChI
InChI=1S/C12H9ClN2O2S/c1-8(17)15(11-4-2-9(13)3-5-11)12-14-10(6-16)7-18-12/h2-7H,1H3
InChIKey
JGIDYFPIKZAFRZ-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)-N-(4-formyl-1,3-thiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.00732 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.01460 160.1
[M+Na]+ 302.99654 172.8
[M+NH4]+ 298.04114 168.3
[M+K]+ 318.97048 166.1
[M-H]- 279.00004 163.6
[M+Na-2H]- 300.98199 167.2
[M]+ 280.00677 163.5
[M]- 280.00787 163.5
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.