CID 7536518

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

Structural Information

Molecular Formula
C6H10N2S
SMILES
CC1=NC(=CS1)CCN
InChI
InChI=1S/C6H10N2S/c1-5-8-6(2-3-7)4-9-5/h4H,2-3,7H2,1H3
InChIKey
GLEZGSKBHYTSAD-UHFFFAOYSA-N
Compound name
2-(2-methyl-1,3-thiazol-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

142.05647 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.063746 127.1
[M+Na]+ 165.045688 136.4
[M-H]- 141.049194 129.6
[M+NH4]+ 160.090293 149.6
[M+K]+ 181.019628 134.0
[M+H-H2O]+ 125.053730 121.2
[M+HCOO]- 187.054671 147.2
[M+CH3COO]- 201.070321 174.1
[M+Na-2H]- 163.031136 129.6
[M]+ 142.05592142 128.1
[M]- 142.05701858 128.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe