CID 129958915

En300-26913612

Structural Information

Molecular Formula
C11H20ClNO4S
SMILES
CC(C)(C)OC(=O)NC1CCC(CC1)S(=O)(=O)Cl
InChI
InChI=1S/C11H20ClNO4S/c1-11(2,3)17-10(14)13-8-4-6-9(7-5-8)18(12,15)16/h8-9H,4-7H2,1-3H3,(H,13,14)
InChIKey
WGFZGDZJMGHURP-UHFFFAOYSA-N
Compound name
tert-butyl N-(4-chlorosulfonylcyclohexyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.08017 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.08745 164.1
[M+Na]+ 320.06939 169.3
[M-H]- 296.07289 167.2
[M+NH4]+ 315.11399 180.5
[M+K]+ 336.04333 166.4
[M+H-H2O]+ 280.07743 159.8
[M+HCOO]- 342.07837 172.3
[M+CH3COO]- 356.09402 197.4
[M+Na-2H]- 318.05484 166.0
[M]+ 297.07962 166.1
[M]- 297.08072 166.1
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

No patent data available for this compound.