CID 206142

Acetamide, 2-((3-chloro(1,1'-biphenyl)-4-yl)oxy)-n-(2-(diethylamino)ethyl)-, monohydrochloride

Structural Information

Molecular Formula
C20H25ClN2O2
SMILES
CCN(CC)CCNC(=O)COC1=C(C=C(C=C1)C2=CC=CC=C2)Cl
InChI
InChI=1S/C20H25ClN2O2/c1-3-23(4-2)13-12-22-20(24)15-25-19-11-10-17(14-18(19)21)16-8-6-5-7-9-16/h5-11,14H,3-4,12-13,15H2,1-2H3,(H,22,24)
InChIKey
HMXIMANEHWPRFG-UHFFFAOYSA-N
Compound name
2-(2-chloro-4-phenylphenoxy)-N-[2-(diethylamino)ethyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

360.16046 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 361.16774 188.3
[M+Na]+ 383.14968 193.2
[M-H]- 359.15318 195.3
[M+NH4]+ 378.19428 201.7
[M+K]+ 399.12362 188.5
[M+H-H2O]+ 343.15772 179.6
[M+HCOO]- 405.15866 208.2
[M+CH3COO]- 419.17431 222.5
[M+Na-2H]- 381.13513 189.8
[M]+ 360.15991 193.8
[M]- 360.16101 193.8
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.