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

7
Patents

252.12627 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.133546 157.8
[M+Na]+ 275.115488 166.2
[M-H]- 251.118994 164.1
[M+NH4]+ 270.160093 173.2
[M+K]+ 291.089428 160.7
[M+H-H2O]+ 235.123530 148.8
[M+HCOO]- 297.124471 178.3
[M+CH3COO]- 311.140121 169.7
[M+Na-2H]- 273.100936 160.9
[M]+ 252.12572142 156.1
[M]- 252.12681858 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