CID 68287297

1-(pyridin-3-yl)-2-(pyrrolidin-1-yl)ethan-1-amine trihydrochloride

Structural Information

Molecular Formula
C11H17N3
SMILES
C1CCN(C1)CC(C2=CN=CC=C2)N
InChI
InChI=1S/C11H17N3/c12-11(9-14-6-1-2-7-14)10-4-3-5-13-8-10/h3-5,8,11H,1-2,6-7,9,12H2
InChIKey
KTRFDUIBRFJHGJ-UHFFFAOYSA-N
Compound name
1-pyridin-3-yl-2-pyrrolidin-1-ylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

191.14224 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.14952 143.7
[M+Na]+ 214.13146 148.3
[M-H]- 190.13496 146.4
[M+NH4]+ 209.17606 161.2
[M+K]+ 230.10540 145.7
[M+H-H2O]+ 174.13950 134.9
[M+HCOO]- 236.14044 163.8
[M+CH3COO]- 250.15609 184.0
[M+Na-2H]- 212.11691 147.1
[M]+ 191.14169 138.4
[M]- 191.14279 138.4
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