CID 6481019

2-hydroxy-4-methyl-n-thiazol-5-yl-benzamide

Structural Information

Molecular Formula
C11H10N2O2S
SMILES
CC1=CC(=C(C=C1)C(=O)NC2=CN=CS2)O
InChI
InChI=1S/C11H10N2O2S/c1-7-2-3-8(9(14)4-7)11(15)13-10-5-12-6-16-10/h2-6,14H,1H3,(H,13,15)
InChIKey
LWFNMCZVAPZMDO-UHFFFAOYSA-N
Compound name
2-hydroxy-4-methyl-N-(1,3-thiazol-5-yl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

234.0463 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.05358 149.5
[M+Na]+ 257.03552 158.3
[M-H]- 233.03902 154.7
[M+NH4]+ 252.08012 167.6
[M+K]+ 273.00946 154.3
[M+H-H2O]+ 217.04356 142.8
[M+HCOO]- 279.04450 168.5
[M+CH3COO]- 293.06015 187.3
[M+Na-2H]- 255.02097 151.2
[M]+ 234.04575 151.0
[M]- 234.04685 151.0
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.