CID 80365559

4-bromo-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C3H3BrN2O
SMILES
C1=NOC(=C1Br)N
InChI
InChI=1S/C3H3BrN2O/c4-2-1-6-7-3(2)5/h1H,5H2
InChIKey
MHYZYNGBKVRPNT-UHFFFAOYSA-N
Compound name
4-bromo-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.94289 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.95017 122.4
[M+Na]+ 184.93211 135.4
[M-H]- 160.93561 128.2
[M+NH4]+ 179.97671 145.4
[M+K]+ 200.90605 126.6
[M+H-H2O]+ 144.94015 122.2
[M+HCOO]- 206.94109 145.4
[M+CH3COO]- 220.95674 174.2
[M+Na-2H]- 182.91756 131.7
[M]+ 161.94234 140.4
[M]- 161.94344 140.4
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.