CID 88576

4,5-diphenyl-2-(1-piperazinyl)oxazole

Structural Information

Molecular Formula
C19H19N3O
SMILES
C1CN(CCN1)C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C19H19N3O/c1-3-7-15(8-4-1)17-18(16-9-5-2-6-10-16)23-19(21-17)22-13-11-20-12-14-22/h1-10,20H,11-14H2
InChIKey
ZZMAMUSXLOFMFS-UHFFFAOYSA-N
Compound name
4,5-diphenyl-2-piperazin-1-yl-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

305.1528 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.160076 171.8
[M+Na]+ 328.142018 177.2
[M-H]- 304.145524 179.0
[M+NH4]+ 323.186623 181.0
[M+K]+ 344.115958 171.5
[M+H-H2O]+ 288.150060 160.2
[M+HCOO]- 350.151001 187.2
[M+CH3COO]- 364.166651 180.9
[M+Na-2H]- 326.127466 174.3
[M]+ 305.15225142 166.1
[M]- 305.15334858 166.1
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

patents stripe