CID 3068073

5-thiazolecarboxamide, n,4-dimethyl-2-(2-methoxyphenyl)-

Structural Information

Molecular Formula
C13H14N2O2S
SMILES
CC1=C(SC(=N1)C2=CC=CC=C2OC)C(=O)NC
InChI
InChI=1S/C13H14N2O2S/c1-8-11(12(16)14-2)18-13(15-8)9-6-4-5-7-10(9)17-3/h4-7H,1-3H3,(H,14,16)
InChIKey
RWQUXMQQPCENOI-UHFFFAOYSA-N
Compound name
2-(2-methoxyphenyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

262.0776 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.08488 158.2
[M+Na]+ 285.06682 167.4
[M-H]- 261.07032 164.8
[M+NH4]+ 280.11142 176.2
[M+K]+ 301.04076 163.8
[M+H-H2O]+ 245.07486 151.1
[M+HCOO]- 307.07580 178.0
[M+CH3COO]- 321.09145 197.0
[M+Na-2H]- 283.05227 158.6
[M]+ 262.07705 162.6
[M]- 262.07815 162.6
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

patents stripe