CID 27211

1-(2,6-dichlorophenyl)-2-indolinone

Structural Information

Molecular Formula
C14H9Cl2NO
SMILES
C1C2=CC=CC=C2N(C1=O)C3=C(C=CC=C3Cl)Cl
InChI
InChI=1S/C14H9Cl2NO/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(17)18/h1-7H,8H2
InChIKey
JCICIFOYVSPMHG-UHFFFAOYSA-N
Compound name
1-(2,6-dichlorophenyl)-3H-indol-2-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

22
References

140
Patents

277.00613 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.01341 159.6
[M+Na]+ 299.99535 171.6
[M-H]- 275.99885 165.6
[M+NH4]+ 295.03995 178.8
[M+K]+ 315.96929 164.2
[M+H-H2O]+ 260.00339 153.2
[M+HCOO]- 322.00433 172.2
[M+CH3COO]- 336.01998 172.3
[M+Na-2H]- 297.98080 162.5
[M]+ 277.00558 162.8
[M]- 277.00668 162.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe