CID 218841

Thiazolidine, 3-(3-(5-bromo-2-pyridyloxy)propyl)-, hydrochloride

Structural Information

Molecular Formula
C11H15BrN2OS
SMILES
C1CSCN1CCCOC2=NC=C(C=C2)Br
InChI
InChI=1S/C11H15BrN2OS/c12-10-2-3-11(13-8-10)15-6-1-4-14-5-7-16-9-14/h2-3,8H,1,4-7,9H2
InChIKey
NCDRKMPFBDDYQD-UHFFFAOYSA-N
Compound name
3-[3-(5-bromopyridin-2-yl)oxypropyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

302.00885 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.01613 154.2
[M+Na]+ 324.99807 156.4
[M+NH4]+ 320.04267 159.1
[M+K]+ 340.97201 155.6
[M-H]- 301.00157 155.4
[M+Na-2H]- 322.98352 157.3
[M]+ 302.00830 154.0
[M]- 302.00940 154.0
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