CID 135705567

3-(5-phenyl-1,3,4-oxadiazol-2-ylimino)indolin-2-one

Structural Information

Molecular Formula
C16H10N4O2
SMILES
C1=CC=C(C=C1)C2=NN=C(O2)/N=C/3\C4=CC=CC=C4NC3=O
InChI
InChI=1S/C16H10N4O2/c21-14-13(11-8-4-5-9-12(11)17-14)18-16-20-19-15(22-16)10-6-2-1-3-7-10/h1-9H,(H,17,18,20,21)
InChIKey
DUOJLCAFEKDDJW-UHFFFAOYSA-N
Compound name
(3E)-3-[(5-phenyl-1,3,4-oxadiazol-2-yl)imino]-1H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.08038 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.08766 164.5
[M+Na]+ 313.06960 178.7
[M+NH4]+ 308.11420 171.8
[M+K]+ 329.04354 175.7
[M-H]- 289.07310 170.3
[M+Na-2H]- 311.05505 172.6
[M]+ 290.07983 168.0
[M]- 290.08093 168.0
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.