CID 842777

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

Structural Information

Molecular Formula
C12H14N2S
SMILES
CC1=CC(=C(C=C1)C)C2=C(SC(=N2)N)C
InChI
InChI=1S/C12H14N2S/c1-7-4-5-8(2)10(6-7)11-9(3)15-12(13)14-11/h4-6H,1-3H3,(H2,13,14)
InChIKey
DYUTXEVRMPFGTH-UHFFFAOYSA-N
Compound name
4-(2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3761
Patents

218.08777 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.09505 148.7
[M+Na]+ 241.07699 162.2
[M+NH4]+ 236.12159 158.2
[M+K]+ 257.05093 154.7
[M-H]- 217.08049 153.6
[M+Na-2H]- 239.06244 156.0
[M]+ 218.08722 152.5
[M]- 218.08832 152.5
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

patents stripe