CID 3040580

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

Structural Information

Molecular Formula
C16H30N2O3
SMILES
CCCN1CC(OC(=O)C1=O)CN(CC(C)C)CC(C)C
InChI
InChI=1S/C16H30N2O3/c1-6-7-18-11-14(21-16(20)15(18)19)10-17(8-12(2)3)9-13(4)5/h12-14H,6-11H2,1-5H3
InChIKey
YSWYQCVHBXEWNY-UHFFFAOYSA-N
Compound name
6-[[bis(2-methylpropyl)amino]methyl]-4-propylmorpholine-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.22565 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.23293 174.9
[M+Na]+ 321.21487 182.8
[M+NH4]+ 316.25947 180.0
[M+K]+ 337.18881 178.8
[M-H]- 297.21837 176.1
[M+Na-2H]- 319.20032 175.1
[M]+ 298.22510 175.9
[M]- 298.22620 175.9
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.