CID 70399

Famoxon

Structural Information

Molecular Formula

C₁₀H₁₆NO₆PS

SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)OP(=O)(OC)OC

InChI

InChI=1S/C10H16NO6PS/c1-11(2)19(13,14)10-7-5-9(6-8-10)17-18(12,15-3)16-4/h5-8H,1-4H3

InChIKey

SGSHKKZZKAZVCW-UHFFFAOYSA-N

Compound name

[4-(dimethylsulfamoyl)phenyl] dimethyl phosphate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 309.0436 Da
Monoisotopic Mass: 0.6
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]+	310.05088	164.3
[M+Na]+	332.03282	172.2
[M+NH4]+	327.07742	168.9
[M+K]+	348.00676	168.7
[M-H]-	308.03632	162.7
[M+Na-2H]-	330.01827	167.7
[M]+	309.04305	165.1
[M]-	309.04415	165.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe