CID 10725403

2-(pyridin-3-yl)propan-2-ol

Structural Information

Molecular Formula
C8H11NO
SMILES
CC(C)(C1=CN=CC=C1)O
InChI
InChI=1S/C8H11NO/c1-8(2,10)7-4-3-5-9-6-7/h3-6,10H,1-2H3
InChIKey
QYTIJLGACUHBPY-UHFFFAOYSA-N
Compound name
2-pyridin-3-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

315
Patents

137.08406 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.091336 127.9
[M+Na]+ 160.073278 135.9
[M-H]- 136.076784 129.1
[M+NH4]+ 155.117883 147.9
[M+K]+ 176.047218 134.1
[M+H-H2O]+ 120.081320 122.5
[M+HCOO]- 182.082261 148.7
[M+CH3COO]- 196.097911 170.6
[M+Na-2H]- 158.058726 136.9
[M]+ 137.08351142 127.1
[M]- 137.08460858 127.1
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