CID 69344413

Rac-n-[(1r,2r)-2-aminocyclohexyl]methanesulfonamide hydrochloride

Structural Information

Molecular Formula
C7H16N2O2S
SMILES
CS(=O)(=O)N[C@@H]1CCCC[C@H]1N
InChI
InChI=1S/C7H16N2O2S/c1-12(10,11)9-7-5-3-2-4-6(7)8/h6-7,9H,2-5,8H2,1H3/t6-,7-/m1/s1
InChIKey
QSISIEZCYJFVIK-RNFRBKRXSA-N
Compound name
N-[(1R,2R)-2-aminocyclohexyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

192.09325 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.10053 139.5
[M+Na]+ 215.08247 144.6
[M-H]- 191.08597 141.9
[M+NH4]+ 210.12707 158.4
[M+K]+ 231.05641 142.3
[M+H-H2O]+ 175.09051 133.8
[M+HCOO]- 237.09145 155.5
[M+CH3COO]- 251.10710 183.3
[M+Na-2H]- 213.06792 142.5
[M]+ 192.09270 135.3
[M]- 192.09380 135.3
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