CID 199186

Sydnone, 3-(p-chlorophenyl)-4-phenyl-

Structural Information

Molecular Formula
C14H10ClN2O2
SMILES
C1=CC=C(C=C1)C2=[N+](NOC2=O)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C14H9ClN2O2/c15-11-6-8-12(9-7-11)17-13(14(18)19-16-17)10-4-2-1-3-5-10/h1-9H/p+1
InChIKey
SVTPHHFBWMHXOU-UHFFFAOYSA-O
Compound name
3-(4-chlorophenyl)-4-phenyl-2H-oxadiazol-3-ium-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.0431 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.05038 156.3
[M+Na]+ 296.03232 175.6
[M+NH4]+ 291.07692 165.7
[M+K]+ 312.00626 170.0
[M-H]- 272.03582 164.1
[M+Na-2H]- 294.01777 167.5
[M]+ 273.04255 162.1
[M]- 273.04365 162.1
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

No patent data available for this compound.