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]+ 381.25365 198.3
[M+Na]+ 403.23559 200.5
[M-H]- 379.23909 203.4
[M+NH4]+ 398.28019 209.1
[M+K]+ 419.20953 195.3
[M+H-H2O]+ 363.24363 188.4
[M+HCOO]- 425.24457 220.0
[M+CH3COO]- 439.26022 227.0
[M+Na-2H]- 401.22104 197.8
[M]+ 380.24582 200.1
[M]- 380.24692 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.