CID 83670763

Octahydropyrido[2,1-c]morpholine-6,8-dione

Structural Information

Molecular Formula
C8H11NO3
SMILES
C1COCC2N1C(=O)CC(=O)C2
InChI
InChI=1S/C8H11NO3/c10-7-3-6-5-12-2-1-9(6)8(11)4-7/h6H,1-5H2
InChIKey
CRYSSONOZFXMES-UHFFFAOYSA-N
Compound name
3,4,9,9a-tetrahydro-1H-pyrido[2,1-c][1,4]oxazine-6,8-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.0739 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.081176 132.4
[M+Na]+ 192.063118 138.9
[M-H]- 168.066624 135.4
[M+NH4]+ 187.107723 151.0
[M+K]+ 208.037058 138.7
[M+H-H2O]+ 152.071160 126.0
[M+HCOO]- 214.072101 148.7
[M+CH3COO]- 228.087751 177.0
[M+Na-2H]- 190.048566 138.9
[M]+ 169.07335142 128.3
[M]- 169.07444858 128.3
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.

Patent stripe

No patent data available for this compound.