CID 3041013

53298-10-5

Structural Information

Molecular Formula

C₁₅H₂₁N₃O₃S

SMILES

C1CCC(CC1)N2CC(=O)N(C2)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C15H21N3O3S/c16-22(20,21)14-8-6-13(7-9-14)18-11-17(10-15(18)19)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H2,16,20,21)

InChIKey

LUIZATPCSQGSQG-UHFFFAOYSA-N

Compound name

4-(3-cyclohexyl-5-oxoimidazolidin-1-yl)benzenesulfonamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 323.13037 Da
Monoisotopic Mass: 1.6
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]+	324.137646	174.9
[M+Na]+	346.119588	180.4
[M-H]-	322.123094	181.0
[M+NH4]+	341.164193	187.7
[M+K]+	362.093528	175.8
[M+H-H2O]+	306.127630	166.8
[M+HCOO]-	368.128571	186.5
[M+CH3COO]-	382.144221	203.9
[M+Na-2H]-	344.105036	173.4
[M]+	323.12982142	170.2
[M]-	323.13091858	170.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe