CID 12459258

1,14-diazacyclohexacosane-2,15-dione

Structural Information

Molecular Formula
C24H46N2O2
SMILES
C1CCCCCC(=O)NCCCCCCCCCCCC(=O)NCCCCC1
InChI
InChI=1S/C24H46N2O2/c27-23-19-15-11-7-3-1-5-9-13-17-21-25-24(28)20-16-12-8-4-2-6-10-14-18-22-26-23/h1-22H2,(H,25,28)(H,26,27)
InChIKey
QIAFMOCNLCQPND-UHFFFAOYSA-N
Compound name
1,14-diazacyclohexacosane-2,15-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

394.35593 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.363206 199.7
[M+Na]+ 417.345148 193.5
[M-H]- 393.348654 195.3
[M+NH4]+ 412.389753 201.3
[M+K]+ 433.319088 189.5
[M+H-H2O]+ 377.353190 194.0
[M+HCOO]- 439.354131 200.8
[M+CH3COO]- 453.369781 200.0
[M+Na-2H]- 415.330596 191.9
[M]+ 394.35538142 174.6
[M]- 394.35647858 174.6
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

patents stripe