CID 3062752

98836-60-3

Structural Information

Molecular Formula
C21H25N3
SMILES
CCC(CN(C)C)(C1=CC=CC=C1)N2C=CN=C2C3=CC=CC=C3
InChI
InChI=1S/C21H25N3/c1-4-21(17-23(2)3,19-13-9-6-10-14-19)24-16-15-22-20(24)18-11-7-5-8-12-18/h5-16H,4,17H2,1-3H3
InChIKey
CDFAPOVQEMBLDN-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-phenyl-2-(2-phenylimidazol-1-yl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.20483 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.212106 179.2
[M+Na]+ 342.194048 184.5
[M-H]- 318.197554 187.1
[M+NH4]+ 337.238653 192.3
[M+K]+ 358.167988 179.8
[M+H-H2O]+ 302.202090 168.5
[M+HCOO]- 364.203031 200.5
[M+CH3COO]- 378.218681 213.7
[M+Na-2H]- 340.179496 183.1
[M]+ 319.20428142 180.2
[M]- 319.20537858 180.2
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

No patent data available for this compound.