CID 3056388

Alpha-(beta-dimethylaminoethoxy)-alpha-methyl-alpha-(2-thienyl)-2-picolide hydrochloride

Structural Information

Molecular Formula
C15H20N2OS
SMILES
CC(C1=CC=CC=N1)(C2=CC=CS2)OCCN(C)C
InChI
InChI=1S/C15H20N2OS/c1-15(14-8-6-12-19-14,18-11-10-17(2)3)13-7-4-5-9-16-13/h4-9,12H,10-11H2,1-3H3
InChIKey
QHMNZJORATXYFO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(1-pyridin-2-yl-1-thiophen-2-ylethoxy)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.12964 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.13692 165.0
[M+Na]+ 299.11886 176.0
[M+NH4]+ 294.16346 173.6
[M+K]+ 315.09280 169.2
[M-H]- 275.12236 168.9
[M+Na-2H]- 297.10431 172.8
[M]+ 276.12909 168.2
[M]- 276.13019 168.2
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.