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]+ 316.23833 179.6
[M+Na]+ 338.22027 181.5
[M-H]- 314.22377 185.6
[M+NH4]+ 333.26487 193.9
[M+K]+ 354.19421 178.0
[M+H-H2O]+ 298.22831 169.9
[M+HCOO]- 360.22925 196.3
[M+CH3COO]- 374.24490 208.9
[M+Na-2H]- 336.20572 174.8
[M]+ 315.23050 174.3
[M]- 315.23160 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.