CID 252545

4-amino-n-(4-hydroxycyclohexyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C12H18N2O3S
SMILES
C1CC(CCC1NS(=O)(=O)C2=CC=C(C=C2)N)O
InChI
InChI=1S/C12H18N2O3S/c13-9-1-7-12(8-2-9)18(16,17)14-10-3-5-11(15)6-4-10/h1-2,7-8,10-11,14-15H,3-6,13H2
InChIKey
VKVIEHIBAUUKCF-UHFFFAOYSA-N
Compound name
4-amino-N-(4-hydroxycyclohexyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

270.10382 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.111096 157.6
[M+Na]+ 293.093038 162.3
[M-H]- 269.096544 161.7
[M+NH4]+ 288.137643 172.5
[M+K]+ 309.066978 158.0
[M+H-H2O]+ 253.101080 150.8
[M+HCOO]- 315.102021 172.4
[M+CH3COO]- 329.117671 195.3
[M+Na-2H]- 291.078486 160.3
[M]+ 270.10327142 152.9
[M]- 270.10436858 152.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.