CID 3087344

5-((4-(diphenylmethyl)-1-piperazinyl)methyl)-2-oxazolidinone dihydrochloride

Structural Information

Molecular Formula
C21H25N3O2
SMILES
C1CN(CCN1CC2CNC(=O)O2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C21H25N3O2/c25-21-22-15-19(26-21)16-23-11-13-24(14-12-23)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-10,19-20H,11-16H2,(H,22,25)
InChIKey
CQRNLXGLYJUTRY-UHFFFAOYSA-N
Compound name
5-[(4-benzhydrylpiperazin-1-yl)methyl]-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

351.19467 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.20195 187.0
[M+Na]+ 374.18389 199.4
[M+NH4]+ 369.22849 193.6
[M+K]+ 390.15783 194.1
[M-H]- 350.18739 193.5
[M+Na-2H]- 372.16934 194.3
[M]+ 351.19412 190.4
[M]- 351.19522 190.4
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

patents stripe