CID 2776502

(6-phenoxypyridin-3-yl)methanol

Structural Information

Molecular Formula
C12H11NO2
SMILES
C1=CC=C(C=C1)OC2=NC=C(C=C2)CO
InChI
InChI=1S/C12H11NO2/c14-9-10-6-7-12(13-8-10)15-11-4-2-1-3-5-11/h1-8,14H,9H2
InChIKey
ZAKRVFYNLKKPOF-UHFFFAOYSA-N
Compound name
(6-phenoxy-3-pyridinyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

201.07898 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.086256 141.9
[M+Na]+ 224.068198 149.8
[M-H]- 200.071704 146.0
[M+NH4]+ 219.112803 158.8
[M+K]+ 240.042138 146.4
[M+H-H2O]+ 184.076240 134.1
[M+HCOO]- 246.077181 164.6
[M+CH3COO]- 260.092831 181.3
[M+Na-2H]- 222.053646 150.0
[M]+ 201.07843142 142.1
[M]- 201.07952858 142.1
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