CID 205699

Oxazole, 4,5-diphenyl-2-(1-pyrrolidinyl)-

Structural Information

Molecular Formula
C19H18N2O
SMILES
C1CCN(C1)C2=NC(=C(O2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C19H18N2O/c1-3-9-15(10-4-1)17-18(16-11-5-2-6-12-16)22-19(20-17)21-13-7-8-14-21/h1-6,9-12H,7-8,13-14H2
InChIKey
POWXJOMDSQMVOK-UHFFFAOYSA-N
Compound name
4,5-diphenyl-2-pyrrolidin-1-yl-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

290.1419 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.14918 166.2
[M+Na]+ 313.13112 173.0
[M-H]- 289.13462 177.0
[M+NH4]+ 308.17572 180.4
[M+K]+ 329.10506 168.9
[M+H-H2O]+ 273.13916 156.5
[M+HCOO]- 335.14010 187.0
[M+CH3COO]- 349.15575 177.8
[M+Na-2H]- 311.11657 167.3
[M]+ 290.14135 164.4
[M]- 290.14245 164.4
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