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
3
Annotation Hits

0
References

55
Patents

268.12454 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.131816 159.2
[M+Na]+ 291.113758 163.4
[M-H]- 267.117264 165.8
[M+NH4]+ 286.158363 175.4
[M+K]+ 307.087698 160.5
[M+H-H2O]+ 251.121800 151.7
[M+HCOO]- 313.122741 175.4
[M+CH3COO]- 327.138391 200.5
[M+Na-2H]- 289.099206 161.5
[M]+ 268.12399142 156.1
[M]- 268.12508858 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