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]+ 307.180496 174.3
[M+Na]+ 329.162438 181.3
[M-H]- 305.165944 181.0
[M+NH4]+ 324.207043 187.8
[M+K]+ 345.136378 175.5
[M+H-H2O]+ 289.170480 163.7
[M+HCOO]- 351.171421 196.2
[M+CH3COO]- 365.187071 185.1
[M+Na-2H]- 327.147886 177.2
[M]+ 306.17267142 176.6
[M]- 306.17376858 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.