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]+ 306.16008 171.8
[M+Na]+ 328.14202 177.2
[M-H]- 304.14552 179.0
[M+NH4]+ 323.18662 181.0
[M+K]+ 344.11596 171.5
[M+H-H2O]+ 288.15006 160.2
[M+HCOO]- 350.15100 187.2
[M+CH3COO]- 364.16665 180.9
[M+Na-2H]- 326.12747 174.3
[M]+ 305.15225 166.1
[M]- 305.15335 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