CID 154875881

2503207-61-0

Structural Information

Molecular Formula
C8H16N2OS
SMILES
C1CNCCC12CCS(=N)(=O)C2
InChI
InChI=1S/C8H16N2OS/c9-12(11)6-3-8(7-12)1-4-10-5-2-8/h9-10H,1-7H2
InChIKey
FXVJZAABNLAUQN-UHFFFAOYSA-N
Compound name
2-imino-2lambda6-thia-8-azaspiro[4.5]decane 2-oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.09833 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.10561 138.8
[M+Na]+ 211.08755 145.0
[M-H]- 187.09105 141.1
[M+NH4]+ 206.13215 162.3
[M+K]+ 227.06149 141.6
[M+H-H2O]+ 171.09559 133.9
[M+HCOO]- 233.09653 152.3
[M+CH3COO]- 247.11218 150.4
[M+Na-2H]- 209.07300 142.8
[M]+ 188.09778 131.5
[M]- 188.09888 131.5
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

No patent data available for this compound.