CID 24701426

1-sulfamoylpiperidine-4-carboxylic acid

Structural Information

Molecular Formula
C6H12N2O4S
SMILES
C1CN(CCC1C(=O)O)S(=O)(=O)N
InChI
InChI=1S/C6H12N2O4S/c7-13(11,12)8-3-1-5(2-4-8)6(9)10/h5H,1-4H2,(H,9,10)(H2,7,11,12)
InChIKey
RHSCFCIWXIKLFP-UHFFFAOYSA-N
Compound name
1-sulfamoylpiperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

208.05177 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.05905 141.6
[M+Na]+ 231.04099 147.2
[M-H]- 207.04449 141.5
[M+NH4]+ 226.08559 157.8
[M+K]+ 247.01493 145.2
[M+H-H2O]+ 191.04903 135.8
[M+HCOO]- 253.04997 153.8
[M+CH3COO]- 267.06562 179.8
[M+Na-2H]- 229.02644 143.4
[M]+ 208.05122 138.0
[M]- 208.05232 138.0
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