CID 737887

4-methyl-2-phenyl-1,3-thiazole-5-carboxamide

Structural Information

Molecular Formula
C11H10N2OS
SMILES
CC1=C(SC(=N1)C2=CC=CC=C2)C(=O)N
InChI
InChI=1S/C11H10N2OS/c1-7-9(10(12)14)15-11(13-7)8-5-3-2-4-6-8/h2-6H,1H3,(H2,12,14)
InChIKey
HGWKKGLUWKNUOF-UHFFFAOYSA-N
Compound name
4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

5
Patents

218.05139 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.05867 146.7
[M+Na]+ 241.04061 158.8
[M+NH4]+ 236.08521 155.4
[M+K]+ 257.01455 152.6
[M-H]- 217.04411 150.6
[M+Na-2H]- 239.02606 153.9
[M]+ 218.05084 149.9
[M]- 218.05194 149.9
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

patents stripe