CID 3067393

N,n-dimethyl-gamma,4-diphenyl-1-piperazinepropanamine maleate (1:2)

Structural Information

Molecular Formula
C21H29N3
SMILES
CN(C)CCC(C1=CC=CC=C1)N2CCN(CC2)C3=CC=CC=C3
InChI
InChI=1S/C21H29N3/c1-22(2)14-13-21(19-9-5-3-6-10-19)24-17-15-23(16-18-24)20-11-7-4-8-12-20/h3-12,21H,13-18H2,1-2H3
InChIKey
AFYBXFXHPZCGAO-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-phenyl-3-(4-phenylpiperazin-1-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.23615 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.24343 181.3
[M+Na]+ 346.22537 182.8
[M-H]- 322.22887 187.4
[M+NH4]+ 341.26997 191.8
[M+K]+ 362.19931 178.4
[M+H-H2O]+ 306.23341 169.3
[M+HCOO]- 368.23435 198.0
[M+CH3COO]- 382.25000 215.3
[M+Na-2H]- 344.21082 183.0
[M]+ 323.23560 176.9
[M]- 323.23670 176.9
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

patents stripe