CID 165499150

2241141-01-3

Structural Information

Molecular Formula
C12H19N3O
SMILES
CN(C)CC1=NC=CC(=C1)OC2CCNC2
InChI
InChI=1S/C12H19N3O/c1-15(2)9-10-7-11(4-6-14-10)16-12-3-5-13-8-12/h4,6-7,12-13H,3,5,8-9H2,1-2H3
InChIKey
IRRWDIFIZILJHY-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1-(4-pyrrolidin-3-yloxypyridin-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.15282 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.16010 151.1
[M+Na]+ 244.14204 156.1
[M-H]- 220.14554 154.5
[M+NH4]+ 239.18664 167.8
[M+K]+ 260.11598 154.0
[M+H-H2O]+ 204.15008 142.2
[M+HCOO]- 266.15102 171.7
[M+CH3COO]- 280.16667 190.8
[M+Na-2H]- 242.12749 154.2
[M]+ 221.15227 148.9
[M]- 221.15337 148.9
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.