CID 22254216

(6-phenylpyridin-3-yl)methanol

Structural Information

Molecular Formula
C12H11NO
SMILES
C1=CC=C(C=C1)C2=NC=C(C=C2)CO
InChI
InChI=1S/C12H11NO/c14-9-10-6-7-12(13-8-10)11-4-2-1-3-5-11/h1-8,14H,9H2
InChIKey
RXXIVABOKBNIEI-UHFFFAOYSA-N
Compound name
(6-phenylpyridin-3-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

91
Patents

185.08406 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.09134 138.5
[M+Na]+ 208.07328 146.6
[M-H]- 184.07678 142.7
[M+NH4]+ 203.11788 156.2
[M+K]+ 224.04722 142.6
[M+H-H2O]+ 168.08132 131.1
[M+HCOO]- 230.08226 161.1
[M+CH3COO]- 244.09791 151.6
[M+Na-2H]- 206.05873 146.7
[M]+ 185.08351 137.4
[M]- 185.08461 137.4
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