CID 62370366

Methyl(pyridin-3-ylmethyl)(pyrrolidin-3-ylmethyl)amine

Structural Information

Molecular Formula
C12H19N3
SMILES
CN(CC1CCNC1)CC2=CN=CC=C2
InChI
InChI=1S/C12H19N3/c1-15(10-12-4-6-14-8-12)9-11-3-2-5-13-7-11/h2-3,5,7,12,14H,4,6,8-10H2,1H3
InChIKey
MTSQXKHRXWCBSI-UHFFFAOYSA-N
Compound name
N-methyl-N-(pyridin-3-ylmethyl)-1-pyrrolidin-3-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.1579 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.16518 147.9
[M+Na]+ 228.14712 152.0
[M-H]- 204.15062 150.9
[M+NH4]+ 223.19172 165.1
[M+K]+ 244.12106 149.5
[M+H-H2O]+ 188.15516 138.9
[M+HCOO]- 250.15610 168.3
[M+CH3COO]- 264.17175 187.7
[M+Na-2H]- 226.13257 151.7
[M]+ 205.15735 143.9
[M]- 205.15845 143.9
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.