CID 66520387

5-propylpyridin-3-ol

Structural Information

Molecular Formula
C8H11NO
SMILES
CCCC1=CC(=CN=C1)O
InChI
InChI=1S/C8H11NO/c1-2-3-7-4-8(10)6-9-5-7/h4-6,10H,2-3H2,1H3
InChIKey
LAVZJGKJJZAPBI-UHFFFAOYSA-N
Compound name
5-propylpyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

137.08406 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.09134 127.5
[M+Na]+ 160.07328 140.8
[M+NH4]+ 155.11788 136.2
[M+K]+ 176.04722 134.2
[M-H]- 136.07678 129.1
[M+Na-2H]- 158.05873 134.9
[M]+ 137.08351 129.8
[M]- 137.08461 129.8
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