CID 74892541

(4-ethynylpyridin-2-yl)methanol

Structural Information

Molecular Formula
C8H7NO
SMILES
C#CC1=CC(=NC=C1)CO
InChI
InChI=1S/C8H7NO/c1-2-7-3-4-9-8(5-7)6-10/h1,3-5,10H,6H2
InChIKey
DCUZCUDKCHSLKT-UHFFFAOYSA-N
Compound name
(4-ethynylpyridin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

133.05276 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 134.06004 127.0
[M+Na]+ 156.04198 140.0
[M+NH4]+ 151.08658 131.9
[M+K]+ 172.01592 130.7
[M-H]- 132.04548 120.4
[M+Na-2H]- 154.02743 131.2
[M]+ 133.05221 126.1
[M]- 133.05331 126.1
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