CID 205696

Brn 1109614

Structural Information

Molecular Formula
C9H8N2O3
SMILES
C1C2=CC=CC=C2OC(=O)N1C(=O)N
InChI
InChI=1S/C9H8N2O3/c10-8(12)11-5-6-3-1-2-4-7(6)14-9(11)13/h1-4H,5H2,(H2,10,12)
InChIKey
KSFQRTUMPUMUJN-UHFFFAOYSA-N
Compound name
2-oxo-4H-1,3-benzoxazine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.0535 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.060776 137.6
[M+Na]+ 215.042718 145.8
[M-H]- 191.046224 141.1
[M+NH4]+ 210.087323 155.0
[M+K]+ 231.016658 144.7
[M+H-H2O]+ 175.050760 130.7
[M+HCOO]- 237.051701 157.4
[M+CH3COO]- 251.067351 183.5
[M+Na-2H]- 213.028166 144.7
[M]+ 192.05295142 135.9
[M]- 192.05404858 135.9
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.