CID 3039792

51246-67-4

Structural Information

Molecular Formula
C19H29N3O
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C(CN2CCCC2)N3CCCC3
InChI
InChI=1S/C19H29N3O/c1-15-8-7-9-16(2)18(15)20-19(23)17(22-12-5-6-13-22)14-21-10-3-4-11-21/h7-9,17H,3-6,10-14H2,1-2H3,(H,20,23)
InChIKey
VAINNPXMBCNGSB-UHFFFAOYSA-N
Compound name
N-(2,6-dimethylphenyl)-2,3-dipyrrolidin-1-ylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

315.23105 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.238326 179.6
[M+Na]+ 338.220268 181.5
[M-H]- 314.223774 185.6
[M+NH4]+ 333.264873 193.9
[M+K]+ 354.194208 178.0
[M+H-H2O]+ 298.228310 169.9
[M+HCOO]- 360.229251 196.3
[M+CH3COO]- 374.244901 208.9
[M+Na-2H]- 336.205716 174.8
[M]+ 315.23050142 174.3
[M]- 315.23159858 174.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.