CID 16782110

N-[3-(1-aminoethyl)phenyl]benzamide

Structural Information

Molecular Formula
C15H16N2O
SMILES
CC(C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)N
InChI
InChI=1S/C15H16N2O/c1-11(16)13-8-5-9-14(10-13)17-15(18)12-6-3-2-4-7-12/h2-11H,16H2,1H3,(H,17,18)
InChIKey
APIGOJRNVDUCJS-UHFFFAOYSA-N
Compound name
N-[3-(1-aminoethyl)phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.12627 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.133546 155.7
[M+Na]+ 263.115488 160.9
[M-H]- 239.118994 161.8
[M+NH4]+ 258.160093 172.0
[M+K]+ 279.089428 157.3
[M+H-H2O]+ 223.123530 147.8
[M+HCOO]- 285.124471 179.6
[M+CH3COO]- 299.140121 197.7
[M+Na-2H]- 261.100936 159.8
[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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.