CID 18216

2-imidazoline, 2-(o-methylbenzyl)-

Structural Information

Molecular Formula
C11H14N2
SMILES
CC1=CC=CC=C1CC2=NCCN2
InChI
InChI=1S/C11H14N2/c1-9-4-2-3-5-10(9)8-11-12-6-7-13-11/h2-5H,6-8H2,1H3,(H,12,13)
InChIKey
ADABQLGCWDRNAU-UHFFFAOYSA-N
Compound name
2-[(2-methylphenyl)methyl]-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

174.11569 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.122966 138.4
[M+Na]+ 197.104908 145.8
[M-H]- 173.108414 140.9
[M+NH4]+ 192.149513 156.9
[M+K]+ 213.078848 141.9
[M+H-H2O]+ 157.112950 130.5
[M+HCOO]- 219.113891 159.0
[M+CH3COO]- 233.129541 150.8
[M+Na-2H]- 195.090356 143.3
[M]+ 174.11514142 135.3
[M]- 174.11623858 135.3
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