CID 210605

21412-95-3

Structural Information

Molecular Formula
C7H8N2O3
SMILES
C1CC2=C(C(=O)NC(=O)O2)NC1
InChI
InChI=1S/C7H8N2O3/c10-6-5-4(2-1-3-8-5)12-7(11)9-6/h8H,1-3H2,(H,9,10,11)
InChIKey
WVWCUJZTIBLKPL-UHFFFAOYSA-N
Compound name
5,6,7,8-tetrahydropyrido[2,3-e][1,3]oxazine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

168.0535 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.060776 130.5
[M+Na]+ 191.042718 139.8
[M-H]- 167.046224 130.5
[M+NH4]+ 186.087323 146.7
[M+K]+ 207.016658 137.1
[M+H-H2O]+ 151.050760 123.8
[M+HCOO]- 213.051701 147.1
[M+CH3COO]- 227.067351 170.8
[M+Na-2H]- 189.028166 139.3
[M]+ 168.05295142 127.3
[M]- 168.05404858 127.3
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

patents stripe