CID 877260

4-cyclohexylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C12H17NO2S
SMILES
C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)N
InChI
InChI=1S/C12H17NO2S/c13-16(14,15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h6-10H,1-5H2,(H2,13,14,15)
InChIKey
BVXOWKKFUMLIDX-UHFFFAOYSA-N
Compound name
4-cyclohexylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

18
Patents

239.098 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.105276 151.8
[M+Na]+ 262.087218 157.3
[M-H]- 238.090724 157.3
[M+NH4]+ 257.131823 169.0
[M+K]+ 278.061158 153.4
[M+H-H2O]+ 222.095260 145.2
[M+HCOO]- 284.096201 167.0
[M+CH3COO]- 298.111851 189.1
[M+Na-2H]- 260.072666 154.6
[M]+ 239.09745142 147.9
[M]- 239.09854858 147.9
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

patents stripe