CID 125425761

2-thiaspiro[3.5]nonan-7-amine;hydrochloride

Structural Information

Molecular Formula
C8H15NS
SMILES
C1CC2(CCC1N)CSC2
InChI
InChI=1S/C8H15NS/c9-7-1-3-8(4-2-7)5-10-6-8/h7H,1-6,9H2
InChIKey
MZAWAFWUIKXAJA-UHFFFAOYSA-N
Compound name
2-thiaspiro[3.5]nonan-7-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.09251 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.09979 128.3
[M+Na]+ 180.08173 133.1
[M+NH4]+ 175.12633 136.1
[M+K]+ 196.05567 125.7
[M-H]- 156.08523 129.5
[M+Na-2H]- 178.06718 132.8
[M]+ 157.09196 128.6
[M]- 157.09306 128.6
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.