CID 712445

2-(4-methyl-1,3-thiazol-2-yl)acetamide

Structural Information

Molecular Formula
C6H8N2OS
SMILES
CC1=CSC(=N1)CC(=O)N
InChI
InChI=1S/C6H8N2OS/c1-4-3-10-6(8-4)2-5(7)9/h3H,2H2,1H3,(H2,7,9)
InChIKey
AOBLTBKNIPVVET-UHFFFAOYSA-N
Compound name
2-(4-methyl-1,3-thiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

47
Patents

156.03574 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.04302 130.6
[M+Na]+ 179.02496 139.6
[M-H]- 155.02846 133.2
[M+NH4]+ 174.06956 152.3
[M+K]+ 194.99890 137.6
[M+H-H2O]+ 139.03300 124.6
[M+HCOO]- 201.03394 150.0
[M+CH3COO]- 215.04959 176.0
[M+Na-2H]- 177.01041 132.0
[M]+ 156.03519 131.6
[M]- 156.03629 131.6
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