CID 205597

1-pyrrolidinecarboxamide, n,n'-ethylenebis(n-butyl-

Structural Information

Molecular Formula
C20H38N4O2
SMILES
CCCCN(CCN(CCCC)C(=O)N1CCCC1)C(=O)N2CCCC2
InChI
InChI=1S/C20H38N4O2/c1-3-5-11-23(19(25)21-13-7-8-14-21)17-18-24(12-6-4-2)20(26)22-15-9-10-16-22/h3-18H2,1-2H3
InChIKey
BMPGOUVTFQPZSX-UHFFFAOYSA-N
Compound name
N-butyl-N-[2-[butyl(pyrrolidine-1-carbonyl)amino]ethyl]pyrrolidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

366.29947 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 367.306746 197.7
[M+Na]+ 389.288688 195.7
[M-H]- 365.292194 201.9
[M+NH4]+ 384.333293 210.7
[M+K]+ 405.262628 195.6
[M+H-H2O]+ 349.296730 187.1
[M+HCOO]- 411.297671 215.0
[M+CH3COO]- 425.313321 224.7
[M+Na-2H]- 387.274136 191.1
[M]+ 366.29892142 196.7
[M]- 366.30001858 196.7
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.