CID 65596622

3-cyclopropyl-1-(pyridin-3-yl)propan-1-amine dihydrochloride

Structural Information

Molecular Formula
C11H16N2
SMILES
C1CC1CCC(C2=CN=CC=C2)N
InChI
InChI=1S/C11H16N2/c12-11(6-5-9-3-4-9)10-2-1-7-13-8-10/h1-2,7-9,11H,3-6,12H2
InChIKey
UXBAKLNWIOGFPT-UHFFFAOYSA-N
Compound name
3-cyclopropyl-1-pyridin-3-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.13135 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.138626 139.3
[M+Na]+ 199.120568 146.8
[M-H]- 175.124074 144.6
[M+NH4]+ 194.165173 152.7
[M+K]+ 215.094508 143.3
[M+H-H2O]+ 159.128610 131.6
[M+HCOO]- 221.129551 162.2
[M+CH3COO]- 235.145201 186.7
[M+Na-2H]- 197.106016 145.2
[M]+ 176.13080142 139.2
[M]- 176.13189858 139.2
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.