CID 3064988

106147-58-4

Structural Information

Molecular Formula
C18H18N2O
SMILES
COC(C1=CN=CN1)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C18H18N2O/c1-21-18(16-12-19-13-20-16)17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13,17-18H,1H3,(H,19,20)
InChIKey
YJAXSNDVBWXAFA-UHFFFAOYSA-N
Compound name
5-(1-methoxy-2,2-diphenylethyl)-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.1419 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.14918 165.2
[M+Na]+ 301.13112 170.1
[M-H]- 277.13462 170.4
[M+NH4]+ 296.17572 178.4
[M+K]+ 317.10506 165.1
[M+H-H2O]+ 261.13916 155.3
[M+HCOO]- 323.14010 184.4
[M+CH3COO]- 337.15575 175.3
[M+Na-2H]- 299.11657 168.1
[M]+ 278.14135 163.1
[M]- 278.14245 163.1
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.