CID 847754

4-amino-n-(2-phenylethyl)benzamide

Structural Information

Molecular Formula
C15H16N2O
SMILES
C1=CC=C(C=C1)CCNC(=O)C2=CC=C(C=C2)N
InChI
InChI=1S/C15H16N2O/c16-14-8-6-13(7-9-14)15(18)17-11-10-12-4-2-1-3-5-12/h1-9H,10-11,16H2,(H,17,18)
InChIKey
MIHLCBDTDZSJDS-UHFFFAOYSA-N
Compound name
4-amino-N-(2-phenylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

6
Patents

240.12627 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.133546 155.1
[M+Na]+ 263.115488 160.5
[M-H]- 239.118994 161.0
[M+NH4]+ 258.160093 171.4
[M+K]+ 279.089428 156.4
[M+H-H2O]+ 223.123530 147.1
[M+HCOO]- 285.124471 180.0
[M+CH3COO]- 299.140121 196.8
[M+Na-2H]- 261.100936 160.4
[M]+ 240.12572142 152.5
[M]- 240.12681858 152.5
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