CID 132992801

Tert-butyl 1-(chlorosulfonyl)piperidine-2-carboxylate

Structural Information

Molecular Formula
C10H18ClNO4S
SMILES
CC(C)(C)OC(=O)C1CCCCN1S(=O)(=O)Cl
InChI
InChI=1S/C10H18ClNO4S/c1-10(2,3)16-9(13)8-6-4-5-7-12(8)17(11,14)15/h8H,4-7H2,1-3H3
InChIKey
DWWBEEZMANLMJO-UHFFFAOYSA-N
Compound name
tert-butyl 1-chlorosulfonylpiperidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

283.0645 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.071776 159.4
[M+Na]+ 306.053718 165.8
[M-H]- 282.057224 161.4
[M+NH4]+ 301.098323 175.3
[M+K]+ 322.027658 163.3
[M+H-H2O]+ 266.061760 154.7
[M+HCOO]- 328.062701 165.7
[M+CH3COO]- 342.078351 192.7
[M+Na-2H]- 304.039166 161.3
[M]+ 283.06395142 162.3
[M]- 283.06504858 162.3
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

No patent data available for this compound.