CID 99366

1-propanesulfonamide, 3-bromo-n-cyclohexyl-

Structural Information

Molecular Formula
C9H18BrNO2S
SMILES
C1CCC(CC1)NS(=O)(=O)CCCBr
InChI
InChI=1S/C9H18BrNO2S/c10-7-4-8-14(12,13)11-9-5-2-1-3-6-9/h9,11H,1-8H2
InChIKey
FJLJOSOWSJGPHE-UHFFFAOYSA-N
Compound name
3-bromo-N-cyclohexylpropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.02417 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.03145 149.0
[M+Na]+ 306.01339 157.0
[M-H]- 282.01689 154.0
[M+NH4]+ 301.05799 168.5
[M+K]+ 321.98733 145.2
[M+H-H2O]+ 266.02143 148.8
[M+HCOO]- 328.02237 162.2
[M+CH3COO]- 342.03802 193.6
[M+Na-2H]- 303.99884 154.0
[M]+ 283.02362 165.7
[M]- 283.02472 165.7
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.