CID 3041530

Brn 0428279

Structural Information

Molecular Formula
C19H25N3O
SMILES
CCC(=O)N(C1=CC=CC=N1)C(C)CN(C)CC2=CC=CC=C2
InChI
InChI=1S/C19H25N3O/c1-4-19(23)22(18-12-8-9-13-20-18)16(2)14-21(3)15-17-10-6-5-7-11-17/h5-13,16H,4,14-15H2,1-3H3
InChIKey
LJUXFGPTAHVRSU-UHFFFAOYSA-N
Compound name
N-[1-[benzyl(methyl)amino]propan-2-yl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.19977 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.20705 177.9
[M+Na]+ 334.18899 180.5
[M-H]- 310.19249 184.8
[M+NH4]+ 329.23359 191.0
[M+K]+ 350.16293 178.9
[M+H-H2O]+ 294.19703 167.5
[M+HCOO]- 356.19797 200.7
[M+CH3COO]- 370.21362 218.5
[M+Na-2H]- 332.17444 180.4
[M]+ 311.19922 179.7
[M]- 311.20032 179.7
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.