CID 89881839

1823496-21-4

Structural Information

Molecular Formula
C10H19NO4S
SMILES
CC(C)(C)OC(=O)N1CCC(CC1)S(=O)O
InChI
InChI=1S/C10H19NO4S/c1-10(2,3)15-9(12)11-6-4-8(5-7-11)16(13)14/h8H,4-7H2,1-3H3,(H,13,14)
InChIKey
NCMYFUBDZACXAW-UHFFFAOYSA-N
Compound name
1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-sulfinic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

249.10349 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.11077 156.2
[M+Na]+ 272.09271 163.2
[M+NH4]+ 267.13731 161.8
[M+K]+ 288.06665 159.1
[M-H]- 248.09621 154.1
[M+Na-2H]- 270.07816 157.1
[M]+ 249.10294 156.6
[M]- 249.10404 156.6
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.