CID 203026

13694-50-3

Structural Information

Molecular Formula
C20H25ClN2O
SMILES
CCOC(CC1=CC=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C20H25ClN2O/c1-2-24-20(16-17-6-4-3-5-7-17)23-14-12-22(13-15-23)19-10-8-18(21)9-11-19/h3-11,20H,2,12-16H2,1H3
InChIKey
DTWMBXXOOWWLTM-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-4-(1-ethoxy-2-phenylethyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.16553 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.17281 184.2
[M+Na]+ 367.15475 199.4
[M+NH4]+ 362.19935 192.7
[M+K]+ 383.12869 189.6
[M-H]- 343.15825 190.1
[M+Na-2H]- 365.14020 193.6
[M]+ 344.16498 188.4
[M]- 344.16608 188.4
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.