CID 209625

Brn 1220652

Structural Information

Molecular Formula
C10H8Br2N2O3
SMILES
C1C2=C(C(=CC(=C2)Br)Br)OC(=O)N1CC(=O)N
InChI
InChI=1S/C10H8Br2N2O3/c11-6-1-5-3-14(4-8(13)15)10(16)17-9(5)7(12)2-6/h1-2H,3-4H2,(H2,13,15)
InChIKey
RZDIJIPQXGVQMY-UHFFFAOYSA-N
Compound name
2-(6,8-dibromo-2-oxo-4H-1,3-benzoxazin-3-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.89017 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.89745 152.6
[M+Na]+ 384.87939 162.5
[M-H]- 360.88289 158.8
[M+NH4]+ 379.92399 167.8
[M+K]+ 400.85333 148.0
[M+H-H2O]+ 344.88743 159.1
[M+HCOO]- 406.88837 164.7
[M+CH3COO]- 420.90402 213.8
[M+Na-2H]- 382.86484 158.1
[M]+ 361.88962 185.8
[M]- 361.89072 185.8
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.