CID 137965660

2230804-10-9

Structural Information

Molecular Formula
C8H15NO3S
SMILES
CNC1CS(=O)(=O)C12CCOCC2
InChI
InChI=1S/C8H15NO3S/c1-9-7-6-13(10,11)8(7)2-4-12-5-3-8/h7,9H,2-6H2,1H3
InChIKey
ZONUQBRFNLQJLA-UHFFFAOYSA-N
Compound name
N-methyl-1,1-dioxo-7-oxa-1lambda6-thiaspiro[3.5]nonan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.07727 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.08455 133.3
[M+Na]+ 228.06649 138.1
[M-H]- 204.06999 139.0
[M+NH4]+ 223.11109 148.5
[M+K]+ 244.04043 140.9
[M+H-H2O]+ 188.07453 123.8
[M+HCOO]- 250.07547 147.7
[M+CH3COO]- 264.09112 185.0
[M+Na-2H]- 226.05194 139.9
[M]+ 205.07672 141.0
[M]- 205.07782 141.0
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

No patent data available for this compound.