CID 82279511

1-amino-2-(pyridin-4-yl)propan-2-ol

Structural Information

Molecular Formula
C8H12N2O
SMILES
CC(CN)(C1=CC=NC=C1)O
InChI
InChI=1S/C8H12N2O/c1-8(11,6-9)7-2-4-10-5-3-7/h2-5,11H,6,9H2,1H3
InChIKey
SELAQYSVQSAABE-UHFFFAOYSA-N
Compound name
1-amino-2-pyridin-4-ylpropan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.09496 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.102236 132.5
[M+Na]+ 175.084178 139.5
[M-H]- 151.087684 133.0
[M+NH4]+ 170.128783 151.1
[M+K]+ 191.058118 137.3
[M+H-H2O]+ 135.092220 126.5
[M+HCOO]- 197.093161 153.7
[M+CH3COO]- 211.108811 174.8
[M+Na-2H]- 173.069626 140.7
[M]+ 152.09441142 129.8
[M]- 152.09550858 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

No patent data available for this compound.