CID 24849100

N-ethyl-2-(4-methoxyphenyl)-n-(2-pyrrolidin-1-ylethyl)ethanamine

Structural Information

Molecular Formula
C17H28N2O
SMILES
CCN(CCC1=CC=C(C=C1)OC)CCN2CCCC2
InChI
InChI=1S/C17H28N2O/c1-3-18(14-15-19-11-4-5-12-19)13-10-16-6-8-17(20-2)9-7-16/h6-9H,3-5,10-15H2,1-2H3
InChIKey
BQAIWMCFNUPLDY-UHFFFAOYSA-N
Compound name
N-ethyl-2-(4-methoxyphenyl)-N-(2-pyrrolidin-1-ylethyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

276.22015 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.22743 169.7
[M+Na]+ 299.20937 172.9
[M-H]- 275.21287 174.9
[M+NH4]+ 294.25397 186.2
[M+K]+ 315.18331 170.6
[M+H-H2O]+ 259.21741 160.5
[M+HCOO]- 321.21835 191.3
[M+CH3COO]- 335.23400 205.7
[M+Na-2H]- 297.19482 170.5
[M]+ 276.21960 170.5
[M]- 276.22070 170.5
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

No patent data available for this compound.