CID 3057339

Pyridine, 2-(alpha-(2-(dimethylamino)ethoxy)-alpha,3,4-trimethylbenzyl)-, hydrochloride

Structural Information

Molecular Formula
C19H26N2O
SMILES
CC1=C(C=C(C=C1)C(C)(C2=CC=CC=N2)OCCN(C)C)C
InChI
InChI=1S/C19H26N2O/c1-15-9-10-17(14-16(15)2)19(3,22-13-12-21(4)5)18-8-6-7-11-20-18/h6-11,14H,12-13H2,1-5H3
InChIKey
WUWZDYVNUSSBCP-UHFFFAOYSA-N
Compound name
2-[1-(3,4-dimethylphenyl)-1-pyridin-2-ylethoxy]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.2045 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.21178 174.4
[M+Na]+ 321.19372 180.3
[M-H]- 297.19722 180.8
[M+NH4]+ 316.23832 188.8
[M+K]+ 337.16766 177.4
[M+H-H2O]+ 281.20176 165.3
[M+HCOO]- 343.20270 195.9
[M+CH3COO]- 357.21835 212.6
[M+Na-2H]- 319.17917 178.8
[M]+ 298.20395 178.0
[M]- 298.20505 178.0
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.