CID 205932

Spiro(quinuclidine-3,2'-thiazolidine), dihydrochloride

Structural Information

Molecular Formula
C9H16N2S
SMILES
C1CN2CCC1C3(C2)NCCS3
InChI
InChI=1S/C9H16N2S/c1-4-11-5-2-8(1)9(7-11)10-3-6-12-9/h8,10H,1-7H2
InChIKey
PZBWZKZALKNSLV-UHFFFAOYSA-N
Compound name
spiro[1,3-thiazolidine-2,3'-1-azabicyclo[2.2.2]octane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

184.10342 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.110696 135.6
[M+Na]+ 207.092638 139.9
[M-H]- 183.096144 130.6
[M+NH4]+ 202.137243 160.7
[M+K]+ 223.066578 137.2
[M+H-H2O]+ 167.100680 130.3
[M+HCOO]- 229.101621 139.1
[M+CH3COO]- 243.117271 145.2
[M+Na-2H]- 205.078086 143.6
[M]+ 184.10287142 133.6
[M]- 184.10396858 133.6
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

patents stripe