CID 155822105

2503202-37-5

Structural Information

Molecular Formula
C8H16N2OS
SMILES
CS(=N)(=O)C1CC2(CCC2)NC1
InChI
InChI=1S/C8H16N2OS/c1-12(9,11)7-5-8(10-6-7)3-2-4-8/h7,9-10H,2-6H2,1H3
InChIKey
XIWBFFPEAPATIW-UHFFFAOYSA-N
Compound name
5-azaspiro[3.4]octan-7-yl-imino-methyl-oxo-lambda6-sulfane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.09833 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10561 139.4
[M+Na]+ 211.08755 141.9
[M+NH4]+ 206.13215 144.6
[M+K]+ 227.06149 138.0
[M-H]- 187.09105 136.9
[M+Na-2H]- 209.07300 141.3
[M]+ 188.09778 138.1
[M]- 188.09888 138.1
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.