CID 33273

2-imidazoline, 2-phenethyl-

Structural Information

Molecular Formula
C11H14N2
SMILES
C1CN=C(N1)CCC2=CC=CC=C2
InChI
InChI=1S/C11H14N2/c1-2-4-10(5-3-1)6-7-11-12-8-9-13-11/h1-5H,6-9H2,(H,12,13)
InChIKey
CPMMXSDLEOJRHI-UHFFFAOYSA-N
Compound name
2-(2-phenylethyl)-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

10
References

47
Patents

174.11569 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.122966 138.3
[M+Na]+ 197.104908 144.7
[M-H]- 173.108414 140.4
[M+NH4]+ 192.149513 156.5
[M+K]+ 213.078848 140.9
[M+H-H2O]+ 157.112950 130.1
[M+HCOO]- 219.113891 158.9
[M+CH3COO]- 233.129541 150.4
[M+Na-2H]- 195.090356 143.9
[M]+ 174.11514142 134.8
[M]- 174.11623858 134.8
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