CID 3275480

22264-19-3

Structural Information

Molecular Formula
C12H22N2O2
SMILES
CCC(C)N1C(=O)CCC(=O)N1C(C)CC
InChI
InChI=1S/C12H22N2O2/c1-5-9(3)13-11(15)7-8-12(16)14(13)10(4)6-2/h9-10H,5-8H2,1-4H3
InChIKey
WKDHKHBYZQXXLA-UHFFFAOYSA-N
Compound name
1,2-di(butan-2-yl)diazinane-3,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.16812 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.17540 155.2
[M+Na]+ 249.15734 164.8
[M+NH4]+ 244.20194 161.1
[M+K]+ 265.13128 160.2
[M-H]- 225.16084 154.4
[M+Na-2H]- 247.14279 156.9
[M]+ 226.16757 155.9
[M]- 226.16867 155.9
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.