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]+ 299.21178 175.2
[M+Na]+ 321.19372 179.0
[M-H]- 297.19722 181.2
[M+NH4]+ 316.23832 191.9
[M+K]+ 337.16766 177.1
[M+H-H2O]+ 281.20176 166.6
[M+HCOO]- 343.20270 198.6
[M+CH3COO]- 357.21835 218.0
[M+Na-2H]- 319.17917 178.3
[M]+ 298.20395 178.7
[M]- 298.20505 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.