CID 3040572

3-isobutyl-5-(morpholinomethyl)-2-oxazolidone hydrobromide

Structural Information

Molecular Formula
C12H22N2O3
SMILES
CC(C)CN1CC(OC1=O)CN2CCOCC2
InChI
InChI=1S/C12H22N2O3/c1-10(2)7-14-9-11(17-12(14)15)8-13-3-5-16-6-4-13/h10-11H,3-9H2,1-2H3
InChIKey
UWLPAFDXOFCXMI-UHFFFAOYSA-N
Compound name
3-(2-methylpropyl)-5-(morpholin-4-ylmethyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

242.16304 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.17032 158.8
[M+Na]+ 265.15226 162.9
[M-H]- 241.15576 162.6
[M+NH4]+ 260.19686 172.3
[M+K]+ 281.12620 163.6
[M+H-H2O]+ 225.16030 150.8
[M+HCOO]- 287.16124 172.5
[M+CH3COO]- 301.17689 191.9
[M+Na-2H]- 263.13771 159.0
[M]+ 242.16249 156.7
[M]- 242.16359 156.7
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.