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]+ 261.159746 161.2
[M+Na]+ 283.141688 167.7
[M-H]- 259.145194 164.9
[M+NH4]+ 278.186293 176.8
[M+K]+ 299.115628 165.1
[M+H-H2O]+ 243.149730 152.0
[M+HCOO]- 305.150671 182.8
[M+CH3COO]- 319.166321 196.2
[M+Na-2H]- 281.127136 164.2
[M]+ 260.15192142 165.0
[M]- 260.15301858 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.