CID 61025121

5-(2,4-dimethylphenyl)-1,3-thiazol-2-amine

Structural Information

Molecular Formula
C11H12N2S
SMILES
CC1=CC(=C(C=C1)C2=CN=C(S2)N)C
InChI
InChI=1S/C11H12N2S/c1-7-3-4-9(8(2)5-7)10-6-13-11(12)14-10/h3-6H,1-2H3,(H2,12,13)
InChIKey
JMERVMVHXNLRMQ-UHFFFAOYSA-N
Compound name
5-(2,4-dimethylphenyl)-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.07211 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.07939 142.6
[M+Na]+ 227.06133 153.2
[M-H]- 203.06483 149.0
[M+NH4]+ 222.10593 163.1
[M+K]+ 243.03527 148.7
[M+H-H2O]+ 187.06937 136.2
[M+HCOO]- 249.07031 162.9
[M+CH3COO]- 263.08596 156.6
[M+Na-2H]- 225.04678 143.9
[M]+ 204.07156 144.0
[M]- 204.07266 144.0
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.