CID 3075121

(z)-1-(2',6'-dichlorophenyl)-3-dimethylaminomethylene-2-indolinone

Structural Information

Molecular Formula
C17H14Cl2N2O
SMILES
CN(C)/C=C\1/C2=CC=CC=C2N(C1=O)C3=C(C=CC=C3Cl)Cl
InChI
InChI=1S/C17H14Cl2N2O/c1-20(2)10-12-11-6-3-4-9-15(11)21(17(12)22)16-13(18)7-5-8-14(16)19/h3-10H,1-2H3/b12-10-
InChIKey
YJGDYQALPAFOPW-BENRWUELSA-N
Compound name
(3Z)-1-(2,6-dichlorophenyl)-3-(dimethylaminomethylidene)indol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.0483 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.05558 173.5
[M+Na]+ 355.03752 189.4
[M+NH4]+ 350.08212 182.7
[M+K]+ 371.01146 181.7
[M-H]- 331.04102 178.4
[M+Na-2H]- 353.02297 180.7
[M]+ 332.04775 177.9
[M]- 332.04885 177.9
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.