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]+ 284.07178 159.4
[M+Na]+ 306.05372 165.8
[M-H]- 282.05722 161.4
[M+NH4]+ 301.09832 175.3
[M+K]+ 322.02766 163.3
[M+H-H2O]+ 266.06176 154.7
[M+HCOO]- 328.06270 165.7
[M+CH3COO]- 342.07835 192.7
[M+Na-2H]- 304.03917 161.3
[M]+ 283.06395 162.3
[M]- 283.06505 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.