CID 12765315

N,n'-dicyclohexylsulfamide

Structural Information

Molecular Formula

C₁₂H₂₄N₂O₂S

SMILES

C1CCC(CC1)NS(=O)(=O)NC2CCCCC2

InChI

InChI=1S/C12H24N2O2S/c15-17(16,13-11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h11-14H,1-10H2

InChIKey

TWRLCLQBOADOST-UHFFFAOYSA-N

Compound name

N-(cyclohexylsulfamoyl)cyclohexanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 27
Patents: 260.15585 Da
Monoisotopic Mass: 2.7
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]+	261.16313	157.2
[M+Na]+	283.14507	157.7
[M-H]-	259.14857	161.3
[M+NH4]+	278.18967	172.7
[M+K]+	299.11901	154.7
[M+H-H2O]+	243.15311	150.0
[M+HCOO]-	305.15405	169.7
[M+CH3COO]-	319.16970	194.8
[M+Na-2H]-	281.13052	159.7
[M]+	260.15530	148.9
[M]-	260.15640	148.9

Literature stripe

literature stripe

Patent stripe

patents stripe