CID 15010

Amidephrine

Structural Information

Molecular Formula

C₁₀H₁₆N₂O₃S

SMILES

CNCC(C1=CC(=CC=C1)NS(=O)(=O)C)O

InChI

InChI=1S/C10H16N2O3S/c1-11-7-10(13)8-4-3-5-9(6-8)12-16(2,14)15/h3-6,10-13H,7H2,1-2H3

InChIKey

ZHOWHMXTJFZXRB-UHFFFAOYSA-N

Compound name

N-[3-[1-hydroxy-2-(methylamino)ethyl]phenyl]methanesulfonamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 40
References: 1641
Patents: 244.08817 Da
Monoisotopic Mass: -1.0
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]+	245.09545	153.3
[M+Na]+	267.07739	161.5
[M+NH4]+	262.12199	159.5
[M+K]+	283.05133	156.0
[M-H]-	243.08089	153.8
[M+Na-2H]-	265.06284	157.5
[M]+	244.08762	154.7
[M]-	244.08872	154.7

Literature stripe

literature stripe

Patent stripe

patents stripe