CID 25323924

Methyl 1-sulfamoylpiperidine-4-carboxylate

Structural Information

Molecular Formula
C7H14N2O4S
SMILES
COC(=O)C1CCN(CC1)S(=O)(=O)N
InChI
InChI=1S/C7H14N2O4S/c1-13-7(10)6-2-4-9(5-3-6)14(8,11)12/h6H,2-5H2,1H3,(H2,8,11,12)
InChIKey
VYJMPDNQCNOVOI-UHFFFAOYSA-N
Compound name
methyl 1-sulfamoylpiperidine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

222.06743 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.07471 145.8
[M+Na]+ 245.05665 151.5
[M-H]- 221.06015 147.0
[M+NH4]+ 240.10125 162.3
[M+K]+ 261.03059 150.2
[M+H-H2O]+ 205.06469 139.6
[M+HCOO]- 267.06563 159.2
[M+CH3COO]- 281.08128 184.6
[M+Na-2H]- 243.04210 147.6
[M]+ 222.06688 144.4
[M]- 222.06798 144.4
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