CID 214673

Verbindungen 341

Structural Information

Molecular Formula
C20H22N2O
SMILES
CCCCN1C=C(N=C1)C2=CC=C(C=C2)OCC3=CC=CC=C3
InChI
InChI=1S/C20H22N2O/c1-2-3-13-22-14-20(21-16-22)18-9-11-19(12-10-18)23-15-17-7-5-4-6-8-17/h4-12,14,16H,2-3,13,15H2,1H3
InChIKey
AWGVBLKUMDHCPA-UHFFFAOYSA-N
Compound name
1-butyl-4-(4-phenylmethoxyphenyl)imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.17322 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.18050 174.3
[M+Na]+ 329.16244 181.3
[M-H]- 305.16594 181.0
[M+NH4]+ 324.20704 187.8
[M+K]+ 345.13638 175.5
[M+H-H2O]+ 289.17048 163.7
[M+HCOO]- 351.17142 196.2
[M+CH3COO]- 365.18707 185.1
[M+Na-2H]- 327.14789 177.2
[M]+ 306.17267 176.6
[M]- 306.17377 176.6
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.