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]+ 207.97162 134.9
[M+Na]+ 229.95356 145.4
[M-H]- 205.95706 140.1
[M+NH4]+ 224.99816 155.4
[M+K]+ 245.92750 136.4
[M+H-H2O]+ 189.96160 133.2
[M+HCOO]- 251.96254 156.4
[M+CH3COO]- 265.97819 183.5
[M+Na-2H]- 227.93901 141.7
[M]+ 206.96379 151.0
[M]- 206.96489 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.