CID 15785876

2-methyl-1-(pyridin-2-yl)propan-1-ol

Structural Information

Molecular Formula
C9H13NO
SMILES
CC(C)C(C1=CC=CC=N1)O
InChI
InChI=1S/C9H13NO/c1-7(2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3
InChIKey
CWQKDQOZSPOCRK-UHFFFAOYSA-N
Compound name
2-methyl-1-pyridin-2-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

151.09972 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.10700 132.6
[M+Na]+ 174.08894 144.7
[M+NH4]+ 169.13354 140.9
[M+K]+ 190.06288 139.3
[M-H]- 150.09244 133.8
[M+Na-2H]- 172.07439 139.2
[M]+ 151.09917 134.6
[M]- 151.10027 134.6
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