CID 3041473

Brn 0491380

Structural Information

Molecular Formula
C20H27N3O
SMILES
CCC(=O)N(C1=CC=CC=N1)C(C)CN(C)CCC2=CC=CC=C2
InChI
InChI=1S/C20H27N3O/c1-4-20(24)23(19-12-8-9-14-21-19)17(2)16-22(3)15-13-18-10-6-5-7-11-18/h5-12,14,17H,4,13,15-16H2,1-3H3
InChIKey
RGBOMZHQPYGKBL-UHFFFAOYSA-N
Compound name
N-[1-[methyl(2-phenylethyl)amino]propan-2-yl]-N-pyridin-2-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.21542 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.222696 182.5
[M+Na]+ 348.204638 184.7
[M-H]- 324.208144 189.2
[M+NH4]+ 343.249243 195.0
[M+K]+ 364.178578 182.8
[M+H-H2O]+ 308.212680 171.9
[M+HCOO]- 370.213621 204.9
[M+CH3COO]- 384.229271 221.4
[M+Na-2H]- 346.190086 184.4
[M]+ 325.21487142 184.6
[M]- 325.21596858 184.6
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.