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]+ 257.12848 158.7
[M+Na]+ 279.11042 164.8
[M-H]- 255.11392 164.5
[M+NH4]+ 274.15502 174.2
[M+K]+ 295.08436 161.0
[M+H-H2O]+ 239.11846 150.6
[M+HCOO]- 301.11940 183.1
[M+CH3COO]- 315.13505 200.2
[M+Na-2H]- 277.09587 162.2
[M]+ 256.12065 157.0
[M]- 256.12175 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.