CID 132371658

Rac-[(1r,3s)-3-aminocyclopentyl]methanesulfonamide hydrochloride

Structural Information

Molecular Formula
C6H14N2O2S
SMILES
C1C[C@H](C[C@H]1CS(=O)(=O)N)N
InChI
InChI=1S/C6H14N2O2S/c7-6-2-1-5(3-6)4-11(8,9)10/h5-6H,1-4,7H2,(H2,8,9,10)/t5-,6+/m0/s1
InChIKey
KOHAHIQTQOBDEU-NTSWFWBYSA-N
Compound name
[(1S,3R)-3-aminocyclopentyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.0776 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.084876 136.8
[M+Na]+ 201.066818 143.4
[M-H]- 177.070324 139.3
[M+NH4]+ 196.111423 157.9
[M+K]+ 217.040758 141.0
[M+H-H2O]+ 161.074860 131.6
[M+HCOO]- 223.075801 154.6
[M+CH3COO]- 237.091451 179.3
[M+Na-2H]- 199.052266 138.0
[M]+ 178.07705142 133.4
[M]- 178.07814858 133.4
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

No patent data available for this compound.