CID 43532698

1403766-89-1

Structural Information

Molecular Formula
C9H18N2O2S
SMILES
C1CNCCC1N2CCS(=O)(=O)CC2
InChI
InChI=1S/C9H18N2O2S/c12-14(13)7-5-11(6-8-14)9-1-3-10-4-2-9/h9-10H,1-8H2
InChIKey
ANXTVEAHYVGSTP-UHFFFAOYSA-N
Compound name
4-piperidin-4-yl-1,4-thiazinane 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

218.1089 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.116176 148.0
[M+Na]+ 241.098118 152.6
[M-H]- 217.101624 149.2
[M+NH4]+ 236.142723 164.9
[M+K]+ 257.072058 149.5
[M+H-H2O]+ 201.106160 140.9
[M+HCOO]- 263.107101 156.9
[M+CH3COO]- 277.122751 179.1
[M+Na-2H]- 239.083566 149.7
[M]+ 218.10835142 140.5
[M]- 218.10944858 140.5
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