CID 99120

50765-88-3

Structural Information

Molecular Formula
C22H30N2O
SMILES
CCN(C)CCC(CC=C(C)C)(C1=CC=CC2=CC=CC=C21)C(=O)N
InChI
InChI=1S/C22H30N2O/c1-5-24(4)16-15-22(21(23)25,14-13-17(2)3)20-12-8-10-18-9-6-7-11-19(18)20/h6-13H,5,14-16H2,1-4H3,(H2,23,25)
InChIKey
BJFPXELCDQCHFX-UHFFFAOYSA-N
Compound name
2-[2-[ethyl(methyl)amino]ethyl]-5-methyl-2-naphthalen-1-ylhex-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.2358 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.243076 187.4
[M+Na]+ 361.225018 190.3
[M-H]- 337.228524 191.3
[M+NH4]+ 356.269623 201.6
[M+K]+ 377.198958 186.5
[M+H-H2O]+ 321.233060 179.5
[M+HCOO]- 383.234001 206.3
[M+CH3COO]- 397.249651 223.3
[M+Na-2H]- 359.210466 188.5
[M]+ 338.23525142 188.0
[M]- 338.23634858 188.0
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.