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]+ 223.074706 145.8
[M+Na]+ 245.056648 151.5
[M-H]- 221.060154 147.0
[M+NH4]+ 240.101253 162.3
[M+K]+ 261.030588 150.2
[M+H-H2O]+ 205.064690 139.6
[M+HCOO]- 267.065631 159.2
[M+CH3COO]- 281.081281 184.6
[M+Na-2H]- 243.042096 147.6
[M]+ 222.06688142 144.4
[M]- 222.06797858 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