CID 55248977

1-(2,2-diethoxyethyl)-2-phenyl-1h-imidazole

Structural Information

Molecular Formula
C15H20N2O2
SMILES
CCOC(CN1C=CN=C1C2=CC=CC=C2)OCC
InChI
InChI=1S/C15H20N2O2/c1-3-18-14(19-4-2)12-17-11-10-16-15(17)13-8-6-5-7-9-13/h5-11,14H,3-4,12H2,1-2H3
InChIKey
PODJFFPKJOLITJ-UHFFFAOYSA-N
Compound name
1-(2,2-diethoxyethyl)-2-phenylimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.15247 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.15975 161.2
[M+Na]+ 283.14169 167.7
[M-H]- 259.14519 164.9
[M+NH4]+ 278.18629 176.8
[M+K]+ 299.11563 165.1
[M+H-H2O]+ 243.14973 152.0
[M+HCOO]- 305.15067 182.8
[M+CH3COO]- 319.16632 196.2
[M+Na-2H]- 281.12714 164.2
[M]+ 260.15192 165.0
[M]- 260.15302 165.0
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.