CID 3040601

4-ethyl-6-(1-piperidinylmethyl)-2,3-morpholinedione monohydrobromide

Structural Information

Molecular Formula
C12H20N2O3
SMILES
CCN1CC(OC(=O)C1=O)CN2CCCCC2
InChI
InChI=1S/C12H20N2O3/c1-2-14-9-10(17-12(16)11(14)15)8-13-6-4-3-5-7-13/h10H,2-9H2,1H3
InChIKey
ZURJAMARAGRHAA-UHFFFAOYSA-N
Compound name
4-ethyl-6-(piperidin-1-ylmethyl)morpholine-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.1474 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.15468 157.4
[M+Na]+ 263.13662 167.9
[M+NH4]+ 258.18122 164.0
[M+K]+ 279.11056 162.6
[M-H]- 239.14012 160.2
[M+Na-2H]- 261.12207 160.4
[M]+ 240.14685 159.3
[M]- 240.14795 159.3
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.

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No patent data available for this compound.