CID 64400138

4,4-dimethylcyclohexane-1-sulfonamide

Structural Information

Molecular Formula
C8H17NO2S
SMILES
CC1(CCC(CC1)S(=O)(=O)N)C
InChI
InChI=1S/C8H17NO2S/c1-8(2)5-3-7(4-6-8)12(9,10)11/h7H,3-6H2,1-2H3,(H2,9,10,11)
InChIKey
OJKXYRPFRFQMNH-UHFFFAOYSA-N
Compound name
4,4-dimethylcyclohexane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

191.098 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.105276 139.6
[M+Na]+ 214.087218 146.0
[M-H]- 190.090724 142.4
[M+NH4]+ 209.131823 161.1
[M+K]+ 230.061158 144.1
[M+H-H2O]+ 174.095260 135.4
[M+HCOO]- 236.096201 154.3
[M+CH3COO]- 250.111851 180.8
[M+Na-2H]- 212.072666 143.2
[M]+ 191.09745142 137.1
[M]- 191.09854858 137.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe