CID 4281892

5,6-dichloro-3-phenylindolin-2-one

Structural Information

Molecular Formula
C14H9Cl2NO
SMILES
C1=CC=C(C=C1)C2C3=CC(=C(C=C3NC2=O)Cl)Cl
InChI
InChI=1S/C14H9Cl2NO/c15-10-6-9-12(7-11(10)16)17-14(18)13(9)8-4-2-1-3-5-8/h1-7,13H,(H,17,18)
InChIKey
FLFQHALOGPZWPF-UHFFFAOYSA-N
Compound name
5,6-dichloro-3-phenyl-1,3-dihydroindol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

277.00613 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.01341 157.4
[M+Na]+ 299.99535 174.1
[M+NH4]+ 295.03995 167.3
[M+K]+ 315.96929 166.3
[M-H]- 275.99885 161.5
[M+Na-2H]- 297.98080 165.2
[M]+ 277.00558 161.7
[M]- 277.00668 161.7
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

patents stripe