CID 125424296

2,3-dibromo-5h,6h,8h-imidazo[2,1-c][1,4]oxazine

Structural Information

Molecular Formula

C₆H₆Br₂N₂O

SMILES

C1COCC2=NC(=C(N21)Br)Br

InChI

InChI=1S/C6H6Br2N2O/c7-5-6(8)10-1-2-11-3-4(10)9-5/h1-3H2

InChIKey

NBYTXFJRHSVZKB-UHFFFAOYSA-N

Compound name

2,3-dibromo-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 279.8847 Da
Monoisotopic Mass: 1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	280.89198	136.4
[M+Na]+	302.87392	148.3
[M-H]-	278.87742	142.6
[M+NH4]+	297.91852	155.7
[M+K]+	318.84786	135.3
[M+H-H2O]+	262.88196	145.1
[M+HCOO]-	324.88290	150.0
[M+CH3COO]-	338.89855	151.0
[M+Na-2H]-	300.85937	144.6
[M]+	279.88415	170.2
[M]-	279.88525	170.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe