CID 1482421

(1s)-1-[4-(1h-imidazol-1-yl)phenyl]ethan-1-ol

Structural Information

Molecular Formula
C11H12N2O
SMILES
C[C@@H](C1=CC=C(C=C1)N2C=CN=C2)O
InChI
InChI=1S/C11H12N2O/c1-9(14)10-2-4-11(5-3-10)13-7-6-12-8-13/h2-9,14H,1H3/t9-/m0/s1
InChIKey
ZILVMLWWVGDAHG-VIFPVBQESA-N
Compound name
(1S)-1-(4-imidazol-1-ylphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.09496 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.102236 140.2
[M+Na]+ 211.084178 148.3
[M-H]- 187.087684 143.3
[M+NH4]+ 206.128783 158.2
[M+K]+ 227.058118 145.1
[M+H-H2O]+ 171.092220 132.4
[M+HCOO]- 233.093161 161.5
[M+CH3COO]- 247.108811 179.7
[M+Na-2H]- 209.069626 144.9
[M]+ 188.09441142 139.4
[M]- 188.09550858 139.4
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.