CID 48822

66984-61-0

Structural Information

Molecular Formula
C13H22N2O4
SMILES
CCOC(C)C1(C(=O)NC(=O)NC1=O)CCC(C)C
InChI
InChI=1S/C13H22N2O4/c1-5-19-9(4)13(7-6-8(2)3)10(16)14-12(18)15-11(13)17/h8-9H,5-7H2,1-4H3,(H2,14,15,16,17,18)
InChIKey
CMIXWYUXKFXUEY-UHFFFAOYSA-N
Compound name
5-(1-ethoxyethyl)-5-(3-methylbutyl)-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.15796 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.16524 164.6
[M+Na]+ 293.14718 172.2
[M+NH4]+ 288.19178 169.6
[M+K]+ 309.12112 167.3
[M-H]- 269.15068 161.4
[M+Na-2H]- 291.13263 165.6
[M]+ 270.15741 164.3
[M]- 270.15851 164.3
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.