CID 988149

303091-17-0

Structural Information

Molecular Formula
C18H19Cl2N3O
SMILES
C1CN(CCN1CC(=O)NC2=C(C(=CC=C2)Cl)Cl)C3=CC=CC=C3
InChI
InChI=1S/C18H19Cl2N3O/c19-15-7-4-8-16(18(15)20)21-17(24)13-22-9-11-23(12-10-22)14-5-2-1-3-6-14/h1-8H,9-13H2,(H,21,24)
InChIKey
NQQBCNJEBNYRTN-UHFFFAOYSA-N
Compound name
N-(2,3-dichlorophenyl)-2-(4-phenylpiperazin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.0905 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.09778 183.3
[M+Na]+ 386.07972 189.3
[M-H]- 362.08322 188.2
[M+NH4]+ 381.12432 193.5
[M+K]+ 402.05366 181.8
[M+H-H2O]+ 346.08776 173.2
[M+HCOO]- 408.08870 191.2
[M+CH3COO]- 422.10435 191.5
[M+Na-2H]- 384.06517 184.5
[M]+ 363.08995 181.9
[M]- 363.09105 181.9
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.