CID 3153474

(3-methoxy-propyl)-pyridin-4-ylmethyl-amine

Structural Information

Molecular Formula
C10H16N2O
SMILES
COCCCNCC1=CC=NC=C1
InChI
InChI=1S/C10H16N2O/c1-13-8-2-5-12-9-10-3-6-11-7-4-10/h3-4,6-7,12H,2,5,8-9H2,1H3
InChIKey
AKJLHLSGKCLQSY-UHFFFAOYSA-N
Compound name
3-methoxy-N-(pyridin-4-ylmethyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.12627 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.13355 139.9
[M+Na]+ 203.11549 145.9
[M-H]- 179.11899 141.6
[M+NH4]+ 198.16009 158.2
[M+K]+ 219.08943 144.1
[M+H-H2O]+ 163.12353 132.5
[M+HCOO]- 225.12447 164.1
[M+CH3COO]- 239.14012 183.8
[M+Na-2H]- 201.10094 148.0
[M]+ 180.12572 141.3
[M]- 180.12682 141.3
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

No patent data available for this compound.