CID 11099836

1,12-diazacyclodocosane-2,11-dione

Structural Information

Molecular Formula
C20H38N2O2
SMILES
C1CCCCCNC(=O)CCCCCCCCC(=O)NCCCC1
InChI
InChI=1S/C20H38N2O2/c23-19-15-11-7-3-4-8-12-16-20(24)22-18-14-10-6-2-1-5-9-13-17-21-19/h1-18H2,(H,21,23)(H,22,24)
InChIKey
SZGFECQCECPUNQ-UHFFFAOYSA-N
Compound name
1,12-diazacyclodocosane-2,11-dione
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

338.29333 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.30061 186.0
[M+Na]+ 361.28255 182.5
[M-H]- 337.28605 181.5
[M+NH4]+ 356.32715 190.5
[M+K]+ 377.25649 178.8
[M+H-H2O]+ 321.29059 180.6
[M+HCOO]- 383.29153 190.3
[M+CH3COO]- 397.30718 191.8
[M+Na-2H]- 359.26800 180.7
[M]+ 338.29278 164.2
[M]- 338.29388 164.2
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.