CID 117802

26505-12-4

Structural Information

Molecular Formula

C₈H₁₂N₂O₃S

SMILES

C1=CC(=CC=C1NN)S(=O)(=O)CCO

InChI

InChI=1S/C8H12N2O3S/c9-10-7-1-3-8(4-2-7)14(12,13)6-5-11/h1-4,10-11H,5-6,9H2

InChIKey

IQIBZZZBPKFTAE-UHFFFAOYSA-N

Compound name

2-(4-hydrazinylphenyl)sulfonylethanol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1
Patents: 216.05687 Da
Monoisotopic Mass: -0.2
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]+	217.06415	144.5
[M+Na]+	239.04609	153.2
[M+NH4]+	234.09069	151.0
[M+K]+	255.02003	147.5
[M-H]-	215.04959	145.2
[M+Na-2H]-	237.03154	149.0
[M]+	216.05632	146.0
[M]-	216.05742	146.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe