CID 3051228

67351-16-0

Structural Information

Molecular Formula
C19H33N3
SMILES
CCN(CC)CCN1C(CN(CC1(C)C)C2=CC=CC=C2)C
InChI
InChI=1S/C19H33N3/c1-6-20(7-2)13-14-22-17(3)15-21(16-19(22,4)5)18-11-9-8-10-12-18/h8-12,17H,6-7,13-16H2,1-5H3
InChIKey
BPSWTGYQKPVOEP-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(2,2,6-trimethyl-4-phenylpiperazin-1-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.26746 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.27474 177.9
[M+Na]+ 326.25668 182.3
[M-H]- 302.26018 182.1
[M+NH4]+ 321.30128 192.8
[M+K]+ 342.23062 179.2
[M+H-H2O]+ 286.26472 168.3
[M+HCOO]- 348.26566 195.1
[M+CH3COO]- 362.28131 214.6
[M+Na-2H]- 324.24213 179.0
[M]+ 303.26691 177.4
[M]- 303.26801 177.4
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.