CID 2392397

N-benzyl-2-chloro-n-(2-phenylethyl)acetamide

Structural Information

Molecular Formula
C17H18ClNO
SMILES
C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)CCl
InChI
InChI=1S/C17H18ClNO/c18-13-17(20)19(14-16-9-5-2-6-10-16)12-11-15-7-3-1-4-8-15/h1-10H,11-14H2
InChIKey
FZAPEQHWBXABLT-UHFFFAOYSA-N
Compound name
N-benzyl-2-chloro-N-(2-phenylethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.1077 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.11498 167.5
[M+Na]+ 310.09692 172.9
[M-H]- 286.10042 174.5
[M+NH4]+ 305.14152 183.7
[M+K]+ 326.07086 168.1
[M+H-H2O]+ 270.10496 159.6
[M+HCOO]- 332.10590 187.2
[M+CH3COO]- 346.12155 204.4
[M+Na-2H]- 308.08237 171.7
[M]+ 287.10715 170.4
[M]- 287.10825 170.4
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.