CID 135417369

4-(4,5-dihydro-1h-imidazol-2-yl)phenol

Structural Information

Molecular Formula
C9H10N2O
SMILES
C1CN=C(N1)C2=CC=C(C=C2)O
InChI
InChI=1S/C9H10N2O/c12-8-3-1-7(2-4-8)9-10-5-6-11-9/h1-4,12H,5-6H2,(H,10,11)
InChIKey
NPDVQVNFWYFKNU-UHFFFAOYSA-N
Compound name
4-(4,5-dihydro-1H-imidazol-2-yl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

162.07932 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.086596 133.0
[M+Na]+ 185.068538 140.8
[M-H]- 161.072044 134.5
[M+NH4]+ 180.113143 151.3
[M+K]+ 201.042478 137.0
[M+H-H2O]+ 145.076580 125.7
[M+HCOO]- 207.077521 153.0
[M+CH3COO]- 221.093171 145.5
[M+Na-2H]- 183.053986 138.5
[M]+ 162.07877142 128.8
[M]- 162.07986858 128.8
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