CID 3079535

4-(2-(diethylamino)ethoxy)-n,n,alpha-trimethylbenzeneethanamine dihydrochloride

Structural Information

Molecular Formula
C17H30N2O
SMILES
CCN(CC)CCOC1=CC=C(C=C1)CC(C)N(C)C
InChI
InChI=1S/C17H30N2O/c1-6-19(7-2)12-13-20-17-10-8-16(9-11-17)14-15(3)18(4)5/h8-11,15H,6-7,12-14H2,1-5H3
InChIKey
SIRAESQCZIFMCQ-UHFFFAOYSA-N
Compound name
1-[4-[2-(diethylamino)ethoxy]phenyl]-N,N-dimethylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.2358 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.243076 173.1
[M+Na]+ 301.225018 176.3
[M-H]- 277.228524 178.4
[M+NH4]+ 296.269623 190.0
[M+K]+ 317.198958 176.2
[M+H-H2O]+ 261.233060 164.8
[M+HCOO]- 323.234001 197.2
[M+CH3COO]- 337.249651 216.2
[M+Na-2H]- 299.210466 174.0
[M]+ 278.23525142 178.1
[M]- 278.23634858 178.1
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.