CID 202134

7548-69-8

Structural Information

Molecular Formula
C11H18N2O4
SMILES
CCC1(C(=O)NC(=O)NC1=O)CC(C)(CC)O
InChI
InChI=1S/C11H18N2O4/c1-4-10(3,17)6-11(5-2)7(14)12-9(16)13-8(11)15/h17H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKey
BIASNACFABGSFQ-UHFFFAOYSA-N
Compound name
5-ethyl-5-(2-hydroxy-2-methylbutyl)-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.12666 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.13394 155.7
[M+Na]+ 265.11588 163.5
[M+NH4]+ 260.16048 160.7
[M+K]+ 281.08982 159.1
[M-H]- 241.11938 151.8
[M+Na-2H]- 263.10133 157.3
[M]+ 242.12611 155.3
[M]- 242.12721 155.3
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.