CID 135410177

4-(pyridin-4-yl)phenol

Structural Information

Molecular Formula
C11H9NO
SMILES
C1=CC(=CC=C1C2=CC=NC=C2)O
InChI
InChI=1S/C11H9NO/c13-11-3-1-9(2-4-11)10-5-7-12-8-6-10/h1-8,13H
InChIKey
DANMQSWQAGVFKV-UHFFFAOYSA-N
Compound name
4-pyridin-4-ylphenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

239
Patents

171.06842 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.075696 133.9
[M+Na]+ 194.057638 142.4
[M-H]- 170.061144 138.3
[M+NH4]+ 189.102243 152.1
[M+K]+ 210.031578 138.7
[M+H-H2O]+ 154.065680 126.7
[M+HCOO]- 216.066621 156.8
[M+CH3COO]- 230.082271 147.4
[M+Na-2H]- 192.043086 142.7
[M]+ 171.06787142 132.4
[M]- 171.06896858 132.4
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

patents stripe