CID 1224897

4,5-dibromothiophene-2-carbohydrazide

Structural Information

Molecular Formula

C₅H₄Br₂N₂OS

SMILES

C1=C(SC(=C1Br)Br)C(=O)NN

InChI

InChI=1S/C5H4Br2N2OS/c6-2-1-3(5(10)9-8)11-4(2)7/h1H,8H2,(H,9,10)

InChIKey

XYZOOBRFZARVRB-UHFFFAOYSA-N

Compound name

4,5-dibromothiophene-2-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 297.8411 Da
Monoisotopic Mass: 2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	298.848376	132.9
[M+Na]+	320.830318	144.7
[M-H]-	296.833824	139.8
[M+NH4]+	315.874923	153.2
[M+K]+	336.804258	127.6
[M+H-H2O]+	280.838360	139.2
[M+HCOO]-	342.839301	147.3
[M+CH3COO]-	356.854951	203.3
[M+Na-2H]-	318.815766	137.2
[M]+	297.84055142	165.9
[M]-	297.84164858	165.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.