CID 132327893

3-bromo-n'-hydroxy-4,5-dihydro-1,2-oxazole-5-carboximidamide

Structural Information

Molecular Formula
C4H6BrN3O2
SMILES
C1C(ON=C1Br)/C(=N/O)/N
InChI
InChI=1S/C4H6BrN3O2/c5-3-1-2(10-8-3)4(6)7-9/h2,9H,1H2,(H2,6,7)
InChIKey
MDEGZQVRSSKJIX-UHFFFAOYSA-N
Compound name
3-bromo-N'-hydroxy-4,5-dihydro-1,2-oxazole-5-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

206.96434 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.971616 134.9
[M+Na]+ 229.953558 145.4
[M-H]- 205.957064 140.1
[M+NH4]+ 224.998163 155.4
[M+K]+ 245.927498 136.4
[M+H-H2O]+ 189.961600 133.2
[M+HCOO]- 251.962541 156.4
[M+CH3COO]- 265.978191 183.5
[M+Na-2H]- 227.939006 141.7
[M]+ 206.96379142 151.0
[M]- 206.96488858 151.0
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.