CID 14397403

3-(pyridin-2-yloxy)propan-1-amine

Structural Information

Molecular Formula
C8H12N2O
SMILES
C1=CC=NC(=C1)OCCCN
InChI
InChI=1S/C8H12N2O/c9-5-3-7-11-8-4-1-2-6-10-8/h1-2,4,6H,3,5,7,9H2
InChIKey
PMHZFXDMLGVRSD-UHFFFAOYSA-N
Compound name
3-pyridin-2-yloxypropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

152.09496 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.10224 131.1
[M+Na]+ 175.08418 138.1
[M-H]- 151.08768 132.7
[M+NH4]+ 170.12878 150.3
[M+K]+ 191.05812 136.4
[M+H-H2O]+ 135.09222 124.2
[M+HCOO]- 197.09316 155.4
[M+CH3COO]- 211.10881 177.1
[M+Na-2H]- 173.06963 139.3
[M]+ 152.09441 130.9
[M]- 152.09551 130.9
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