CID 978664

303118-91-4

Structural Information

Molecular Formula
C20H23ClN2O2
SMILES
CC1=C(C=CC(=C1)Cl)OCC(=O)NC2=CC=C(C=C2)N3CCCCC3
InChI
InChI=1S/C20H23ClN2O2/c1-15-13-16(21)5-10-19(15)25-14-20(24)22-17-6-8-18(9-7-17)23-11-3-2-4-12-23/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,24)
InChIKey
RSBVBGXAURKYAQ-UHFFFAOYSA-N
Compound name
2-(4-chloro-2-methylphenoxy)-N-(4-piperidin-1-ylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.1448 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.152076 185.5
[M+Na]+ 381.134018 190.2
[M-H]- 357.137524 192.5
[M+NH4]+ 376.178623 196.8
[M+K]+ 397.107958 184.1
[M+H-H2O]+ 341.142060 175.6
[M+HCOO]- 403.143001 199.5
[M+CH3COO]- 417.158651 215.0
[M+Na-2H]- 379.119466 186.4
[M]+ 358.14425142 184.4
[M]- 358.14534858 184.4
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.