CID 3070221

Phenol, 2-(4,5-dihydro-1-methyl-5-phenyl-1h-imidazol-2-yl)-

Structural Information

Molecular Formula
C16H16N2O
SMILES
CN1C(CN=C1C2=CC=CC=C2O)C3=CC=CC=C3
InChI
InChI=1S/C16H16N2O/c1-18-14(12-7-3-2-4-8-12)11-17-16(18)13-9-5-6-10-15(13)19/h2-10,14,19H,11H2,1H3
InChIKey
WKQGORHVDYTJFB-UHFFFAOYSA-N
Compound name
2-(1-methyl-5-phenyl-4,5-dihydroimidazol-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

252.12627 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.13355 157.8
[M+Na]+ 275.11549 166.2
[M-H]- 251.11899 164.1
[M+NH4]+ 270.16009 173.2
[M+K]+ 291.08943 160.7
[M+H-H2O]+ 235.12353 148.8
[M+HCOO]- 297.12447 178.3
[M+CH3COO]- 311.14012 169.7
[M+Na-2H]- 273.10094 160.9
[M]+ 252.12572 156.1
[M]- 252.12682 156.1
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

patents stripe