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]+ 288.114976 167.5
[M+Na]+ 310.096918 172.9
[M-H]- 286.100424 174.5
[M+NH4]+ 305.141523 183.7
[M+K]+ 326.070858 168.1
[M+H-H2O]+ 270.104960 159.6
[M+HCOO]- 332.105901 187.2
[M+CH3COO]- 346.121551 204.4
[M+Na-2H]- 308.082366 171.7
[M]+ 287.10715142 170.4
[M]- 287.10824858 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.