CID 43366448

2-{4-[4-(aminomethyl)phenyl]phenoxy}acetamide

Structural Information

Molecular Formula
C15H16N2O2
SMILES
C1=CC(=CC=C1CN)C2=CC=C(C=C2)OCC(=O)N
InChI
InChI=1S/C15H16N2O2/c16-9-11-1-3-12(4-2-11)13-5-7-14(8-6-13)19-10-15(17)18/h1-8H,9-10,16H2,(H2,17,18)
InChIKey
OIKOWZMJHIRODN-UHFFFAOYSA-N
Compound name
2-[4-[4-(aminomethyl)phenyl]phenoxy]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

256.1212 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.128476 158.7
[M+Na]+ 279.110418 164.8
[M-H]- 255.113924 164.5
[M+NH4]+ 274.155023 174.2
[M+K]+ 295.084358 161.0
[M+H-H2O]+ 239.118460 150.6
[M+HCOO]- 301.119401 183.1
[M+CH3COO]- 315.135051 200.2
[M+Na-2H]- 277.095866 162.2
[M]+ 256.12065142 157.0
[M]- 256.12174858 157.0
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.