CID 218837

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

Structural Information

Molecular Formula
C10H13BrN2OS
SMILES
C1CSCN1CCOC2=NC=C(C=C2)Br
InChI
InChI=1S/C10H13BrN2OS/c11-9-1-2-10(12-7-9)14-5-3-13-4-6-15-8-13/h1-2,7H,3-6,8H2
InChIKey
MKEZPQVBMYFIKI-UHFFFAOYSA-N
Compound name
3-[2-(5-bromopyridin-2-yl)oxyethyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.9932 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.00048 148.0
[M+Na]+ 310.98242 159.6
[M-H]- 286.98592 154.9
[M+NH4]+ 306.02702 167.6
[M+K]+ 326.95636 148.5
[M+H-H2O]+ 270.99046 147.5
[M+HCOO]- 332.99140 162.9
[M+CH3COO]- 347.00705 162.3
[M+Na-2H]- 308.96787 151.8
[M]+ 287.99265 167.9
[M]- 287.99375 167.9
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.