CID 116814

2-amino-n-cyclohexyl-n-methylbenzenesulfonamide

Structural Information

Molecular Formula
C13H20N2O2S
SMILES
CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2N
InChI
InChI=1S/C13H20N2O2S/c1-15(11-7-3-2-4-8-11)18(16,17)13-10-6-5-9-12(13)14/h5-6,9-11H,2-4,7-8,14H2,1H3
InChIKey
IPEHSCPRVOWQFQ-UHFFFAOYSA-N
Compound name
2-amino-N-cyclohexyl-N-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

57
Patents

268.12454 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.13182 159.2
[M+Na]+ 291.11376 163.4
[M-H]- 267.11726 165.8
[M+NH4]+ 286.15836 175.4
[M+K]+ 307.08770 160.5
[M+H-H2O]+ 251.12180 151.7
[M+HCOO]- 313.12274 175.4
[M+CH3COO]- 327.13839 200.5
[M+Na-2H]- 289.09921 161.5
[M]+ 268.12399 156.1
[M]- 268.12509 156.1
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