CID 57589975

4-bromofuran-2-carboxamide

Structural Information

Molecular Formula
C5H4BrNO2
SMILES
C1=C(OC=C1Br)C(=O)N
InChI
InChI=1S/C5H4BrNO2/c6-3-1-4(5(7)8)9-2-3/h1-2H,(H2,7,8)
InChIKey
UDNSRLLRTQICFU-UHFFFAOYSA-N
Compound name
4-bromofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

61
Patents

188.94254 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.94982 131.6
[M+Na]+ 211.93176 143.7
[M-H]- 187.93526 138.5
[M+NH4]+ 206.97636 154.6
[M+K]+ 227.90570 134.7
[M+H-H2O]+ 171.93980 131.6
[M+HCOO]- 233.94074 154.5
[M+CH3COO]- 247.95639 179.3
[M+Na-2H]- 209.91721 138.5
[M]+ 188.94199 149.8
[M]- 188.94309 149.8
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

patents stripe