CID 17389974

1-[1-(3-methoxypropyl)pyrrolidin-3-yl]methanamine

Structural Information

Molecular Formula
C9H20N2O
SMILES
COCCCN1CCC(C1)CN
InChI
InChI=1S/C9H20N2O/c1-12-6-2-4-11-5-3-9(7-10)8-11/h9H,2-8,10H2,1H3
InChIKey
FURWGAXOMMXUJR-UHFFFAOYSA-N
Compound name
[1-(3-methoxypropyl)pyrrolidin-3-yl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.15756 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.16484 141.2
[M+Na]+ 195.14678 146.5
[M-H]- 171.15028 142.1
[M+NH4]+ 190.19138 161.5
[M+K]+ 211.12072 145.3
[M+H-H2O]+ 155.15482 134.4
[M+HCOO]- 217.15576 162.9
[M+CH3COO]- 231.17141 182.1
[M+Na-2H]- 193.13223 143.7
[M]+ 172.15701 139.5
[M]- 172.15811 139.5
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.