CID 3044349

Brn 2985590

Structural Information

Molecular Formula
C15H14ClNO2
SMILES
C1=CC(=CC=C1CC2=CC=C(C=C2)Cl)OCC(=O)N
InChI
InChI=1S/C15H14ClNO2/c16-13-5-1-11(2-6-13)9-12-3-7-14(8-4-12)19-10-15(17)18/h1-8H,9-10H2,(H2,17,18)
InChIKey
MYKKZITYSAJNLM-UHFFFAOYSA-N
Compound name
2-[4-[(4-chlorophenyl)methyl]phenoxy]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

275.07132 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.07860 161.2
[M+Na]+ 298.06054 175.7
[M+NH4]+ 293.10514 169.7
[M+K]+ 314.03448 167.5
[M-H]- 274.06404 166.0
[M+Na-2H]- 296.04599 170.1
[M]+ 275.07077 164.9
[M]- 275.07187 164.9
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

patents stripe