CID 3005517

433735-86-5

Structural Information

Molecular Formula
C20H18N2O2
SMILES
COC1=CC=C(C=C1)C2=CC=C(O2)C3=CC=C(C=C3)C4=NCCN4
InChI
InChI=1S/C20H18N2O2/c1-23-17-8-6-15(7-9-17)19-11-10-18(24-19)14-2-4-16(5-3-14)20-21-12-13-22-20/h2-11H,12-13H2,1H3,(H,21,22)
InChIKey
XGHGQUFNSROKMB-UHFFFAOYSA-N
Compound name
2-[4-[5-(4-methoxyphenyl)furan-2-yl]phenyl]-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

10
Patents

318.13684 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.14412 172.9
[M+Na]+ 341.12606 180.5
[M-H]- 317.12956 183.1
[M+NH4]+ 336.17066 185.5
[M+K]+ 357.10000 175.8
[M+H-H2O]+ 301.13410 163.5
[M+HCOO]- 363.13504 193.4
[M+CH3COO]- 377.15069 184.1
[M+Na-2H]- 339.11151 173.5
[M]+ 318.13629 172.9
[M]- 318.13739 172.9
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