CID 138516

N-phenethyl-2-phenylacetamide

Structural Information

Molecular Formula
C16H17NO
SMILES
C1=CC=C(C=C1)CCNC(=O)CC2=CC=CC=C2
InChI
InChI=1S/C16H17NO/c18-16(13-15-9-5-2-6-10-15)17-12-11-14-7-3-1-4-8-14/h1-10H,11-13H2,(H,17,18)
InChIKey
SERBNUYNEAQHNJ-UHFFFAOYSA-N
Compound name
2-phenyl-N-(2-phenylethyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

70
Patents

239.13101 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.13829 155.7
[M+Na]+ 262.12023 160.6
[M-H]- 238.12373 161.7
[M+NH4]+ 257.16483 172.4
[M+K]+ 278.09417 156.5
[M+H-H2O]+ 222.12827 147.7
[M+HCOO]- 284.12921 179.9
[M+CH3COO]- 298.14486 194.3
[M+Na-2H]- 260.10568 161.8
[M]+ 239.13046 154.7
[M]- 239.13156 154.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe