CID 135705562

5-chloro-3-(5-(p-chlorophenyl)-1,3,4-oxadiazol-2-ylimino)-2-indolinone

Structural Information

Molecular Formula
C16H8Cl2N4O2
SMILES
C1=CC(=CC=C1C2=NN=C(O2)/N=C/3\C4=C(C=CC(=C4)Cl)NC3=O)Cl
InChI
InChI=1S/C16H8Cl2N4O2/c17-9-3-1-8(2-4-9)15-21-22-16(24-15)20-13-11-7-10(18)5-6-12(11)19-14(13)23/h1-7H,(H,19,20,22,23)
InChIKey
DVEKASOQLJFRKP-UHFFFAOYSA-N
Compound name
(3E)-5-chloro-3-[[5-(4-chlorophenyl)-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

358.00244 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.00972 182.0
[M+Na]+ 380.99166 194.1
[M-H]- 356.99516 189.7
[M+NH4]+ 376.03626 194.9
[M+K]+ 396.96560 187.3
[M+H-H2O]+ 340.99970 172.7
[M+HCOO]- 403.00064 193.4
[M+CH3COO]- 417.01629 192.9
[M+Na-2H]- 378.97711 182.7
[M]+ 358.00189 186.1
[M]- 358.00299 186.1
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.