CID 96392

29449-91-0

Structural Information

Molecular Formula
C13H23N3O2
SMILES
CN(C)CCOC1=NC(=CC=C1)OCCN(C)C
InChI
InChI=1S/C13H23N3O2/c1-15(2)8-10-17-12-6-5-7-13(14-12)18-11-9-16(3)4/h5-7H,8-11H2,1-4H3
InChIKey
RGIHODWAEHCRBV-UHFFFAOYSA-N
Compound name
2-[6-[2-(dimethylamino)ethoxy]pyridin-2-yl]oxy-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

253.17903 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.18631 160.9
[M+Na]+ 276.16825 166.0
[M-H]- 252.17175 165.4
[M+NH4]+ 271.21285 177.5
[M+K]+ 292.14219 166.7
[M+H-H2O]+ 236.17629 152.1
[M+HCOO]- 298.17723 186.4
[M+CH3COO]- 312.19288 207.9
[M+Na-2H]- 274.15370 165.5
[M]+ 253.17848 167.1
[M]- 253.17958 167.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe