CID 3792021

24962-73-0

Structural Information

Molecular Formula

C₁₁H₁₆N₂O₃S

SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)O)N

InChI

InChI=1S/C11H16N2O3S/c12-10-8-9(4-5-11(10)14)17(15,16)13-6-2-1-3-7-13/h4-5,8,14H,1-3,6-7,12H2

InChIKey

AANCEUVFKUNKKT-UHFFFAOYSA-N

Compound name

2-amino-4-piperidin-1-ylsulfonylphenol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 256.08817 Da
Monoisotopic Mass: 0.9
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]+	257.09545	154.6
[M+Na]+	279.07739	164.4
[M+NH4]+	274.12199	161.5
[M+K]+	295.05133	158.2
[M-H]-	255.08089	156.5
[M+Na-2H]-	277.06284	159.8
[M]+	256.08762	156.7
[M]-	256.08872	156.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe