CID 202348

Piperazine, 1-(2-(2-(diphenylmethoxy)ethoxy)ethyl)-2,4,5-trimethyl-, dihydrochloride, (e)-

Structural Information

Molecular Formula
C24H34N2O2
SMILES
C[C@@H]1CN([C@H](CN1CCOCCOC(C2=CC=CC=C2)C3=CC=CC=C3)C)C
InChI
InChI=1S/C24H34N2O2/c1-20-19-26(21(2)18-25(20)3)14-15-27-16-17-28-24(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-13,20-21,24H,14-19H2,1-3H3/t20-,21+/m0/s1
InChIKey
NOCMEDZBNWJQDQ-LEWJYISDSA-N
Compound name
(2R,5S)-1-[2-(2-benzhydryloxyethoxy)ethyl]-2,4,5-trimethylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.26202 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.269296 198.5
[M+Na]+ 405.251238 201.0
[M-H]- 381.254744 203.4
[M+NH4]+ 400.295843 206.6
[M+K]+ 421.225178 195.9
[M+H-H2O]+ 365.259280 186.3
[M+HCOO]- 427.260221 212.9
[M+CH3COO]- 441.275871 222.2
[M+Na-2H]- 403.236686 197.2
[M]+ 382.26147142 198.1
[M]- 382.26256858 198.1
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.