CID 63156531

1909316-85-3

Structural Information

Molecular Formula
C8H15NS
SMILES
C1CNCCC12CCSC2
InChI
InChI=1S/C8H15NS/c1-4-9-5-2-8(1)3-6-10-7-8/h9H,1-7H2
InChIKey
PALGWPAVZNIEOJ-UHFFFAOYSA-N
Compound name
2-thia-8-azaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

157.09251 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.099786 134.7
[M+Na]+ 180.081728 139.6
[M-H]- 156.085234 136.6
[M+NH4]+ 175.126333 157.7
[M+K]+ 196.055668 137.0
[M+H-H2O]+ 140.089770 129.1
[M+HCOO]- 202.090711 146.8
[M+CH3COO]- 216.106361 146.2
[M+Na-2H]- 178.067176 137.0
[M]+ 157.09196142 127.2
[M]- 157.09305858 127.2
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