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]+ 170.08118 132.4
[M+Na]+ 192.06312 138.9
[M-H]- 168.06662 135.4
[M+NH4]+ 187.10772 151.0
[M+K]+ 208.03706 138.7
[M+H-H2O]+ 152.07116 126.0
[M+HCOO]- 214.07210 148.7
[M+CH3COO]- 228.08775 177.0
[M+Na-2H]- 190.04857 138.9
[M]+ 169.07335 128.3
[M]- 169.07445 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.