CID 3746427

2-(3-methylphenyl)-4,5-dihydro-1h-imidazole

Structural Information

Molecular Formula
C10H12N2
SMILES
CC1=CC(=CC=C1)C2=NCCN2
InChI
InChI=1S/C10H12N2/c1-8-3-2-4-9(7-8)10-11-5-6-12-10/h2-4,7H,5-6H2,1H3,(H,11,12)
InChIKey
FAZYMPYKTJYGNR-UHFFFAOYSA-N
Compound name
2-(3-methylphenyl)-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

13
Patents

160.10005 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.107326 133.8
[M+Na]+ 183.089268 141.7
[M-H]- 159.092774 136.5
[M+NH4]+ 178.133873 153.0
[M+K]+ 199.063208 138.0
[M+H-H2O]+ 143.097310 126.2
[M+HCOO]- 205.098251 154.8
[M+CH3COO]- 219.113901 146.7
[M+Na-2H]- 181.074716 139.3
[M]+ 160.09950142 130.4
[M]- 160.10059858 130.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe