CID 3075125

172371-95-8

Structural Information

Molecular Formula
C17H14Cl2N2O2
SMILES
C1=CC=C2C(=C1)C(=C(N2C3=C(C=CC=C3Cl)Cl)O)C=NCCO
InChI
InChI=1S/C17H14Cl2N2O2/c18-13-5-3-6-14(19)16(13)21-15-7-2-1-4-11(15)12(17(21)23)10-20-8-9-22/h1-7,10,22-23H,8-9H2
InChIKey
NMYMOIIXBNOIRQ-UHFFFAOYSA-N
Compound name
1-(2,6-dichlorophenyl)-3-(2-hydroxyethyliminomethyl)indol-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

348.04324 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.05052 177.4
[M+Na]+ 371.03246 193.8
[M+NH4]+ 366.07706 185.7
[M+K]+ 387.00640 186.0
[M-H]- 347.03596 181.6
[M+Na-2H]- 369.01791 184.9
[M]+ 348.04269 181.6
[M]- 348.04379 181.6
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

No patent data available for this compound.