CID 22279355

Sulfamoyl chloride, (2-phenylethyl)-

Structural Information

Molecular Formula

C₈H₁₀ClNO₂S

SMILES

C1=CC=C(C=C1)CCNS(=O)(=O)Cl

InChI

InChI=1S/C8H10ClNO2S/c9-13(11,12)10-7-6-8-4-2-1-3-5-8/h1-5,10H,6-7H2

InChIKey

UABVLYIRSSTLNA-UHFFFAOYSA-N

Compound name

N-(2-phenylethyl)sulfamoyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 52
Patents: 219.01208 Da
Monoisotopic Mass: 2.3
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]+	220.01936	144.6
[M+Na]+	242.00130	156.4
[M+NH4]+	237.04590	153.0
[M+K]+	257.97524	148.1
[M-H]-	218.00480	146.3
[M+Na-2H]-	239.98675	151.1
[M]+	219.01153	147.4
[M]-	219.01263	147.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe