CID 11171256

1909336-71-5

Structural Information

Molecular Formula
C10H11N3
SMILES
C1=CC=C(C(=C1)CN)C2=NC=CN2
InChI
InChI=1S/C10H11N3/c11-7-8-3-1-2-4-9(8)10-12-5-6-13-10/h1-6H,7,11H2,(H,12,13)
InChIKey
IRPDMVRGNZBTMZ-UHFFFAOYSA-N
Compound name
[2-(1H-imidazol-2-yl)phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

173.09529 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.10257 135.8
[M+Na]+ 196.08451 143.9
[M-H]- 172.08801 138.4
[M+NH4]+ 191.12911 153.9
[M+K]+ 212.05845 139.5
[M+H-H2O]+ 156.09255 127.9
[M+HCOO]- 218.09349 158.7
[M+CH3COO]- 232.10914 148.5
[M+Na-2H]- 194.06996 141.8
[M]+ 173.09474 132.2
[M]- 173.09584 132.2
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

patents stripe