CID 3040578

4-ethyl-6-(diisobutylamino)methyl-2,3-morpholinedione hydrobromide

Structural Information

Molecular Formula
C15H28N2O3
SMILES
CCN1CC(OC(=O)C1=O)CN(CC(C)C)CC(C)C
InChI
InChI=1S/C15H28N2O3/c1-6-17-10-13(20-15(19)14(17)18)9-16(7-11(2)3)8-12(4)5/h11-13H,6-10H2,1-5H3
InChIKey
GPBSPVIWSSLXAN-UHFFFAOYSA-N
Compound name
6-[[bis(2-methylpropyl)amino]methyl]-4-ethylmorpholine-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.21 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.21728 171.2
[M+Na]+ 307.19922 175.2
[M-H]- 283.20272 174.5
[M+NH4]+ 302.24382 185.0
[M+K]+ 323.17316 175.9
[M+H-H2O]+ 267.20726 163.7
[M+HCOO]- 329.20820 187.8
[M+CH3COO]- 343.22385 211.4
[M+Na-2H]- 305.18467 169.4
[M]+ 284.20945 173.5
[M]- 284.21055 173.5
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.