CID 468636

5-bromofuran-2-carbohydrazide

Structural Information

Molecular Formula
C5H5BrN2O2
SMILES
C1=C(OC(=C1)Br)C(=O)NN
InChI
InChI=1S/C5H5BrN2O2/c6-4-2-1-3(10-4)5(9)8-7/h1-2H,7H2,(H,8,9)
InChIKey
AKANWSCBFOMJNS-UHFFFAOYSA-N
Compound name
5-bromofuran-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

43
Patents

203.95345 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.96073 135.4
[M+Na]+ 226.94267 146.5
[M-H]- 202.94617 142.1
[M+NH4]+ 221.98727 157.3
[M+K]+ 242.91661 137.1
[M+H-H2O]+ 186.95071 134.3
[M+HCOO]- 248.95165 159.0
[M+CH3COO]- 262.96730 183.4
[M+Na-2H]- 224.92812 142.5
[M]+ 203.95290 152.6
[M]- 203.95400 152.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe