CID 4302083

N-(2,6-diethylphenyl)-1-naphthamide

Structural Information

Molecular Formula
C21H21NO
SMILES
CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC=CC3=CC=CC=C32
InChI
InChI=1S/C21H21NO/c1-3-15-10-7-11-16(4-2)20(15)22-21(23)19-14-8-12-17-9-5-6-13-18(17)19/h5-14H,3-4H2,1-2H3,(H,22,23)
InChIKey
QCOFEVOCLLATQC-UHFFFAOYSA-N
Compound name
N-(2,6-diethylphenyl)naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.16232 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.169596 173.4
[M+Na]+ 326.151538 180.2
[M-H]- 302.155044 180.8
[M+NH4]+ 321.196143 189.1
[M+K]+ 342.125478 174.5
[M+H-H2O]+ 286.159580 164.8
[M+HCOO]- 348.160521 195.5
[M+CH3COO]- 362.176171 210.4
[M+Na-2H]- 324.136986 177.8
[M]+ 303.16177142 174.0
[M]- 303.16286858 174.0
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.