CID 4961860

5-(4-fluorophenyl)thiophene-2-carbohydrazide

Structural Information

Molecular Formula

C₁₁H₉FN₂OS

SMILES

C1=CC(=CC=C1C2=CC=C(S2)C(=O)NN)F

InChI

InChI=1S/C11H9FN2OS/c12-8-3-1-7(2-4-8)9-5-6-10(16-9)11(15)14-13/h1-6H,13H2,(H,14,15)

InChIKey

XMNWZKXRDIGYBL-UHFFFAOYSA-N

Compound name

5-(4-fluorophenyl)thiophene-2-carbohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 236.04196 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]+	237.049236	148.0
[M+Na]+	259.031178	156.5
[M-H]-	235.034684	153.8
[M+NH4]+	254.075783	167.4
[M+K]+	275.005118	151.9
[M+H-H2O]+	219.039220	140.5
[M+HCOO]-	281.040161	168.7
[M+CH3COO]-	295.055811	192.2
[M+Na-2H]-	257.016626	149.1
[M]+	236.04141142	146.6
[M]-	236.04250858	146.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.