CID 28286206

2-(4-methyl-1,3-thiazol-2-yl)propan-2-amine

Structural Information

Molecular Formula
C7H12N2S
SMILES
CC1=CSC(=N1)C(C)(C)N
InChI
InChI=1S/C7H12N2S/c1-5-4-10-6(9-5)7(2,3)8/h4H,8H2,1-3H3
InChIKey
QAMMWXBMUFXQEB-UHFFFAOYSA-N
Compound name
2-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

156.07211 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.07939 133.0
[M+Na]+ 179.06133 142.2
[M-H]- 155.06483 135.7
[M+NH4]+ 174.10593 155.1
[M+K]+ 195.03527 140.0
[M+H-H2O]+ 139.06937 127.6
[M+HCOO]- 201.07031 151.2
[M+CH3COO]- 215.08596 177.4
[M+Na-2H]- 177.04678 135.7
[M]+ 156.07156 133.8
[M]- 156.07266 133.8
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