CID 62135771

4-(1h-imidazol-1-yl)-2-methylbenzaldehyde

Structural Information

Molecular Formula
C11H10N2O
SMILES
CC1=C(C=CC(=C1)N2C=CN=C2)C=O
InChI
InChI=1S/C11H10N2O/c1-9-6-11(3-2-10(9)7-14)13-5-4-12-8-13/h2-8H,1H3
InChIKey
SGYGODVXSYCHSU-UHFFFAOYSA-N
Compound name
4-imidazol-1-yl-2-methylbenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.07932 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08660 139.8
[M+Na]+ 209.06854 154.2
[M+NH4]+ 204.11314 148.1
[M+K]+ 225.04248 148.8
[M-H]- 185.07204 142.7
[M+Na-2H]- 207.05399 148.5
[M]+ 186.07877 142.6
[M]- 186.07987 142.6
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.