CID 3040576

6-((bis(2-methylpropyl)amino)methyl)-4-methyl-2,3-morpholinedione monohydrobromide

Structural Information

Molecular Formula
C14H26N2O3
SMILES
CC(C)CN(CC1CN(C(=O)C(=O)O1)C)CC(C)C
InChI
InChI=1S/C14H26N2O3/c1-10(2)6-16(7-11(3)4)9-12-8-15(5)13(17)14(18)19-12/h10-12H,6-9H2,1-5H3
InChIKey
RTZVVGZMGNDDFQ-UHFFFAOYSA-N
Compound name
6-[[bis(2-methylpropyl)amino]methyl]-4-methylmorpholine-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.19434 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.201616 166.5
[M+Na]+ 293.183558 171.0
[M-H]- 269.187064 170.0
[M+NH4]+ 288.228163 180.9
[M+K]+ 309.157498 171.9
[M+H-H2O]+ 253.191600 159.2
[M+HCOO]- 315.192541 183.5
[M+CH3COO]- 329.208191 208.4
[M+Na-2H]- 291.169006 165.3
[M]+ 270.19379142 168.5
[M]- 270.19488858 168.5
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.