CID 766998

Adamantane-2-spiro(2'-thiazolidine) hydrochloride

Structural Information

Molecular Formula
C12H19NS
SMILES
C1CSC2(N1)C3CC4CC(C3)CC2C4
InChI
InChI=1S/C12H19NS/c1-2-14-12(13-1)10-4-8-3-9(6-10)7-11(12)5-8/h8-11,13H,1-7H2
InChIKey
OIKHYHCSLBSHJW-UHFFFAOYSA-N
Compound name
spiro[1,3-thiazolidine-2,2'-adamantane]
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

209.12383 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.13111 142.1
[M+Na]+ 232.11305 144.4
[M-H]- 208.11655 137.2
[M+NH4]+ 227.15765 168.3
[M+K]+ 248.08699 140.7
[M+H-H2O]+ 192.12109 136.6
[M+HCOO]- 254.12203 142.5
[M+CH3COO]- 268.13768 150.5
[M+Na-2H]- 230.09850 149.4
[M]+ 209.12328 140.1
[M]- 209.12438 140.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.