CID 10464594

2-[hydroxy(pyridin-3-yl)methyl]prop-2-enenitrile

Structural Information

Molecular Formula
C9H8N2O
SMILES
C=C(C#N)C(C1=CN=CC=C1)O
InChI
InChI=1S/C9H8N2O/c1-7(5-10)9(12)8-3-2-4-11-6-8/h2-4,6,9,12H,1H2
InChIKey
JOTLMTYVEFIXPL-UHFFFAOYSA-N
Compound name
2-[hydroxy(pyridin-3-yl)methyl]prop-2-enenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

160.06366 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.07094 136.6
[M+Na]+ 183.05288 147.8
[M+NH4]+ 178.09748 140.7
[M+K]+ 199.02682 139.5
[M-H]- 159.05638 130.0
[M+Na-2H]- 181.03833 140.1
[M]+ 160.06311 135.3
[M]- 160.06421 135.3
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

No patent data available for this compound.