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]+ 359.009716 182.0
[M+Na]+ 380.991658 194.1
[M-H]- 356.995164 189.7
[M+NH4]+ 376.036263 194.9
[M+K]+ 396.965598 187.3
[M+H-H2O]+ 340.999700 172.7
[M+HCOO]- 403.000641 193.4
[M+CH3COO]- 417.016291 192.9
[M+Na-2H]- 378.977106 182.7
[M]+ 358.00189142 186.1
[M]- 358.00298858 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.