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]+ 299.211776 174.4
[M+Na]+ 321.193718 180.3
[M-H]- 297.197224 180.8
[M+NH4]+ 316.238323 188.8
[M+K]+ 337.167658 177.4
[M+H-H2O]+ 281.201760 165.3
[M+HCOO]- 343.202701 195.9
[M+CH3COO]- 357.218351 212.6
[M+Na-2H]- 319.179166 178.8
[M]+ 298.20395142 178.0
[M]- 298.20504858 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.