CID 3078198

5-glycidyloxy-2,4,5-triphenyl-delta(sup 2)-1,3,4-oxadiazoline

Structural Information

Molecular Formula
C23H20N2O3
SMILES
C1C(O1)COC2(N(N=C(O2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C23H20N2O3/c1-4-10-18(11-5-1)22-24-25(20-14-8-3-9-15-20)23(28-22,27-17-21-16-26-21)19-12-6-2-7-13-19/h1-15,21H,16-17H2
InChIKey
OBTVFJPJWGKGEX-UHFFFAOYSA-N
Compound name
2-(oxiran-2-ylmethoxy)-2,3,5-triphenyl-1,3,4-oxadiazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.1474 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.15468 186.8
[M+Na]+ 395.13662 195.5
[M-H]- 371.14012 200.9
[M+NH4]+ 390.18122 191.6
[M+K]+ 411.11056 193.5
[M+H-H2O]+ 355.14466 176.1
[M+HCOO]- 417.14560 206.2
[M+CH3COO]- 431.16125 197.0
[M+Na-2H]- 393.12207 191.0
[M]+ 372.14685 191.0
[M]- 372.14795 191.0
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.