CID 479982

N,n'-bis(4-butylphenyl)butanediamide

Structural Information

Molecular Formula
C24H32N2O2
SMILES
CCCCC1=CC=C(C=C1)NC(=O)CCC(=O)NC2=CC=C(C=C2)CCCC
InChI
InChI=1S/C24H32N2O2/c1-3-5-7-19-9-13-21(14-10-19)25-23(27)17-18-24(28)26-22-15-11-20(12-16-22)8-6-4-2/h9-16H,3-8,17-18H2,1-2H3,(H,25,27)(H,26,28)
InChIKey
FBVFUZAVMLXTHY-UHFFFAOYSA-N
Compound name
N,N'-bis(4-butylphenyl)butanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

380.24637 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 381.253646 198.3
[M+Na]+ 403.235588 200.5
[M-H]- 379.239094 203.4
[M+NH4]+ 398.280193 209.1
[M+K]+ 419.209528 195.3
[M+H-H2O]+ 363.243630 188.4
[M+HCOO]- 425.244571 220.0
[M+CH3COO]- 439.260221 227.0
[M+Na-2H]- 401.221036 197.8
[M]+ 380.24582142 200.1
[M]- 380.24691858 200.1
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.