CID 455746

Ms-1126

Structural Information

Molecular Formula
C14H12N2OS
SMILES
CCC1=C(N2C=CC=CC2=N1)C(=O)C3=CC=CS3
InChI
InChI=1S/C14H12N2OS/c1-2-10-13(14(17)11-6-5-9-18-11)16-8-4-3-7-12(16)15-10/h3-9H,2H2,1H3
InChIKey
HBMGZWHGTQTPPC-UHFFFAOYSA-N
Compound name
(2-ethylimidazo[1,2-a]pyridin-3-yl)-thiophen-2-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

256.06705 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.07433 157.2
[M+Na]+ 279.05627 169.0
[M-H]- 255.05977 164.1
[M+NH4]+ 274.10087 177.3
[M+K]+ 295.03021 164.6
[M+H-H2O]+ 239.06431 150.7
[M+HCOO]- 301.06525 176.7
[M+CH3COO]- 315.08090 170.9
[M+Na-2H]- 277.04172 158.1
[M]+ 256.06650 163.0
[M]- 256.06760 163.0
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.