CID 218032

4-(1-(4-methoxyphenyl)-3-phenylpropyl)-1-piperazinepropanamine trimaleate

Structural Information

Molecular Formula
C23H33N3O
SMILES
COC1=CC=C(C=C1)C(CCC2=CC=CC=C2)N3CCN(CC3)CCCN
InChI
InChI=1S/C23H33N3O/c1-27-22-11-9-21(10-12-22)23(13-8-20-6-3-2-4-7-20)26-18-16-25(17-19-26)15-5-14-24/h2-4,6-7,9-12,23H,5,8,13-19,24H2,1H3
InChIKey
BRZVFCCXZWRBSO-UHFFFAOYSA-N
Compound name
3-[4-[1-(4-methoxyphenyl)-3-phenylpropyl]piperazin-1-yl]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

367.26236 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.26964 193.9
[M+Na]+ 390.25158 195.2
[M-H]- 366.25508 198.1
[M+NH4]+ 385.29618 201.9
[M+K]+ 406.22552 189.3
[M+H-H2O]+ 350.25962 181.8
[M+HCOO]- 412.26056 208.9
[M+CH3COO]- 426.27621 220.5
[M+Na-2H]- 388.23703 193.5
[M]+ 367.26181 189.8
[M]- 367.26291 189.8
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.