CID 218901

Thiazolidine, 3-(3-(2-quinolyloxy)propyl)-, dihydrochloride

Structural Information

Molecular Formula
C15H18N2OS
SMILES
C1CSCN1CCCOC2=NC3=CC=CC=C3C=C2
InChI
InChI=1S/C15H18N2OS/c1-2-5-14-13(4-1)6-7-15(16-14)18-10-3-8-17-9-11-19-12-17/h1-2,4-7H,3,8-12H2
InChIKey
MFVNMBMZTQKYQY-UHFFFAOYSA-N
Compound name
3-(3-quinolin-2-yloxypropyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.11398 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.121256 161.4
[M+Na]+ 297.103198 168.6
[M-H]- 273.106704 165.8
[M+NH4]+ 292.147803 178.3
[M+K]+ 313.077138 164.1
[M+H-H2O]+ 257.111240 153.2
[M+HCOO]- 319.112181 176.2
[M+CH3COO]- 333.127831 172.4
[M+Na-2H]- 295.088646 163.7
[M]+ 274.11343142 162.9
[M]- 274.11452858 162.9
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.