CID 986276

2-(4-chloro-3-methylphenoxy)-n-[4-(morpholin-4-yl)phenyl]acetamide

Structural Information

Molecular Formula
C19H21ClN2O3
SMILES
CC1=C(C=CC(=C1)OCC(=O)NC2=CC=C(C=C2)N3CCOCC3)Cl
InChI
InChI=1S/C19H21ClN2O3/c1-14-12-17(6-7-18(14)20)25-13-19(23)21-15-2-4-16(5-3-15)22-8-10-24-11-9-22/h2-7,12H,8-11,13H2,1H3,(H,21,23)
InChIKey
XBWOMFNUUPSJCT-UHFFFAOYSA-N
Compound name
2-(4-chloro-3-methylphenoxy)-N-(4-morpholin-4-ylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.12408 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.13136 185.5
[M+Na]+ 383.11330 190.6
[M-H]- 359.11680 193.4
[M+NH4]+ 378.15790 195.3
[M+K]+ 399.08724 186.5
[M+H-H2O]+ 343.12134 175.5
[M+HCOO]- 405.12228 199.0
[M+CH3COO]- 419.13793 214.4
[M+Na-2H]- 381.09875 187.5
[M]+ 360.12353 186.1
[M]- 360.12463 186.1
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.