CID 56972046

220150-70-9

Structural Information

Molecular Formula
C8H18N2O4S2
SMILES
CS(=O)(=O)N[C@H]1CCCC[C@@H]1NS(=O)(=O)C
InChI
InChI=1S/C8H18N2O4S2/c1-15(11,12)9-7-5-3-4-6-8(7)10-16(2,13)14/h7-10H,3-6H2,1-2H3/t7-,8-/m0/s1
InChIKey
JUWLQVLCYRNWSV-YUMQZZPRSA-N
Compound name
N-[(1S,2S)-2-(methanesulfonamido)cyclohexyl]methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

270.0708 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.07808 156.8
[M+Na]+ 293.06002 161.2
[M-H]- 269.06352 158.6
[M+NH4]+ 288.10462 172.3
[M+K]+ 309.03396 157.4
[M+H-H2O]+ 253.06806 150.6
[M+HCOO]- 315.06900 166.3
[M+CH3COO]- 329.08465 194.8
[M+Na-2H]- 291.04547 160.2
[M]+ 270.07025 155.4
[M]- 270.07135 155.4
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

patents stripe