CID 62653162

1248387-59-8

Structural Information

Molecular Formula
C11H10N2OS
SMILES
CC1=C(N=CC=C1)C2=NC=C(S2)C(=O)C
InChI
InChI=1S/C11H10N2OS/c1-7-4-3-5-12-10(7)11-13-6-9(15-11)8(2)14/h3-6H,1-2H3
InChIKey
KCAFZSJYHYCVJZ-UHFFFAOYSA-N
Compound name
1-[2-(3-methylpyridin-2-yl)-1,3-thiazol-5-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.05139 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.05867 147.1
[M+Na]+ 241.04061 160.6
[M+NH4]+ 236.08521 155.6
[M+K]+ 257.01455 153.9
[M-H]- 217.04411 150.1
[M+Na-2H]- 239.02606 154.4
[M]+ 218.05084 150.3
[M]- 218.05194 150.3
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.