CID 21156658

4-methoxy-1-(pyridin-3-yl)butan-1-amine

Structural Information

Molecular Formula
C10H16N2O
SMILES
COCCCC(C1=CN=CC=C1)N
InChI
InChI=1S/C10H16N2O/c1-13-7-3-5-10(11)9-4-2-6-12-8-9/h2,4,6,8,10H,3,5,7,11H2,1H3
InChIKey
FUECMSNVHRHPHT-UHFFFAOYSA-N
Compound name
4-methoxy-1-pyridin-3-ylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.12627 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.133546 141.1
[M+Na]+ 203.115488 146.9
[M-H]- 179.118994 142.4
[M+NH4]+ 198.160093 159.1
[M+K]+ 219.089428 145.2
[M+H-H2O]+ 163.123530 133.8
[M+HCOO]- 225.124471 163.7
[M+CH3COO]- 239.140121 184.0
[M+Na-2H]- 201.100936 146.9
[M]+ 180.12572142 140.9
[M]- 180.12681858 140.9
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

No patent data available for this compound.