CID 4083926

477320-43-7

Structural Information

Molecular Formula
C21H21NO
SMILES
CCC1=CC=C(C=C1)NCCC(=O)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C21H21NO/c1-2-16-7-11-20(12-8-16)22-14-13-21(23)19-10-9-17-5-3-4-6-18(17)15-19/h3-12,15,22H,2,13-14H2,1H3
InChIKey
RVJYUQIACFHCFL-UHFFFAOYSA-N
Compound name
3-(4-ethylanilino)-1-naphthalen-2-ylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.16232 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.16960 174.3
[M+Na]+ 326.15154 189.6
[M+NH4]+ 321.19614 183.7
[M+K]+ 342.12548 179.5
[M-H]- 302.15504 180.8
[M+Na-2H]- 324.13699 184.0
[M]+ 303.16177 178.5
[M]- 303.16287 178.5
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.