CID 24212902

853334-57-3

Structural Information

Molecular Formula
C15H11BrN2O
SMILES
CC1=CC2=NC=C(N2C=C1)C(=O)C3=CC=C(C=C3)Br
InChI
InChI=1S/C15H11BrN2O/c1-10-6-7-18-13(9-17-14(18)8-10)15(19)11-2-4-12(16)5-3-11/h2-9H,1H3
InChIKey
YPGMOKCSLDJKJX-UHFFFAOYSA-N
Compound name
(4-bromophenyl)-(7-methylimidazo[1,2-a]pyridin-3-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.0055 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.012776 163.2
[M+Na]+ 336.994718 177.0
[M-H]- 312.998224 171.7
[M+NH4]+ 332.039323 182.0
[M+K]+ 352.968658 164.8
[M+H-H2O]+ 297.002760 161.9
[M+HCOO]- 359.003701 183.6
[M+CH3COO]- 373.019351 177.8
[M+Na-2H]- 334.980166 169.4
[M]+ 314.00495142 184.4
[M]- 314.00604858 184.4
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.