CID 105523

Einecs 266-862-7

Structural Information

Molecular Formula
C17H19Cl2N3O
SMILES
CCN(CCO)C1=CC(=C(C=C1)N=NC2=C(C=CC(=C2)Cl)Cl)C
InChI
InChI=1S/C17H19Cl2N3O/c1-3-22(8-9-23)14-5-7-16(12(2)10-14)20-21-17-11-13(18)4-6-15(17)19/h4-7,10-11,23H,3,8-9H2,1-2H3
InChIKey
LPTYKUABXWKEEE-UHFFFAOYSA-N
Compound name
2-[4-[(2,5-dichlorophenyl)diazenyl]-N-ethyl-3-methylanilino]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.0905 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.09778 183.7
[M+Na]+ 374.07972 192.2
[M-H]- 350.08322 192.4
[M+NH4]+ 369.12432 199.1
[M+K]+ 390.05366 186.6
[M+H-H2O]+ 334.08776 176.2
[M+HCOO]- 396.08870 202.7
[M+CH3COO]- 410.10435 224.5
[M+Na-2H]- 372.06517 186.4
[M]+ 351.08995 190.7
[M]- 351.09105 190.7
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

No patent data available for this compound.