CID 28564687

2-[(6-methoxypyridin-3-yl)amino]ethan-1-ol

Structural Information

Molecular Formula
C8H12N2O2
SMILES
COC1=NC=C(C=C1)NCCO
InChI
InChI=1S/C8H12N2O2/c1-12-8-3-2-7(6-10-8)9-4-5-11/h2-3,6,9,11H,4-5H2,1H3
InChIKey
FFJDBUIRIXMJOX-UHFFFAOYSA-N
Compound name
2-[(6-methoxy-3-pyridinyl)amino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.08987 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.097146 134.2
[M+Na]+ 191.079088 141.6
[M-H]- 167.082594 135.2
[M+NH4]+ 186.123693 152.5
[M+K]+ 207.053028 139.8
[M+H-H2O]+ 151.087130 127.5
[M+HCOO]- 213.088071 157.8
[M+CH3COO]- 227.103721 178.3
[M+Na-2H]- 189.064536 142.1
[M]+ 168.08932142 134.8
[M]- 168.09041858 134.8
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.