CID 39644

Brn 2464218

Structural Information

Molecular Formula
C19H26N2O
SMILES
CCCCN(CCN(C)C)C(=O)C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C19H26N2O/c1-4-5-13-21(15-14-20(2)3)19(22)18-12-8-10-16-9-6-7-11-17(16)18/h6-12H,4-5,13-15H2,1-3H3
InChIKey
WGAKQOWWULJGAQ-UHFFFAOYSA-N
Compound name
N-butyl-N-[2-(dimethylamino)ethyl]naphthalene-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.2045 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.211776 175.2
[M+Na]+ 321.193718 179.0
[M-H]- 297.197224 181.2
[M+NH4]+ 316.238323 191.9
[M+K]+ 337.167658 177.1
[M+H-H2O]+ 281.201760 166.6
[M+HCOO]- 343.202701 198.6
[M+CH3COO]- 357.218351 218.0
[M+Na-2H]- 319.179166 178.3
[M]+ 298.20395142 178.7
[M]- 298.20504858 178.7
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.