CID 55266193

3-(6-methoxypyridin-3-yl)propan-1-amine

Structural Information

Molecular Formula
C9H14N2O
SMILES
COC1=NC=C(C=C1)CCCN
InChI
InChI=1S/C9H14N2O/c1-12-9-5-4-8(7-11-9)3-2-6-10/h4-5,7H,2-3,6,10H2,1H3
InChIKey
CXRMNOBHRZVQQS-UHFFFAOYSA-N
Compound name
3-(6-methoxypyridin-3-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

166.11061 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.11789 135.8
[M+Na]+ 189.09983 143.3
[M-H]- 165.10333 137.6
[M+NH4]+ 184.14443 154.8
[M+K]+ 205.07377 141.3
[M+H-H2O]+ 149.10787 128.9
[M+HCOO]- 211.10881 159.7
[M+CH3COO]- 225.12446 181.2
[M+Na-2H]- 187.08528 142.6
[M]+ 166.11006 136.3
[M]- 166.11116 136.3
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