CID 2771064

2-(4-bromophenyl)thiazolidine

Structural Information

Molecular Formula

C₉H₁₀BrNS

SMILES

C1CSC(N1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C9H10BrNS/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-4,9,11H,5-6H2

InChIKey

YHMUSIBVYIZADU-UHFFFAOYSA-N

Compound name

2-(4-bromophenyl)-1,3-thiazolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 7
References: 33
Patents: 242.97173 Da
Monoisotopic Mass: 2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	243.97901	137.9
[M+Na]+	265.96095	140.7
[M+NH4]+	261.00555	144.1
[M+K]+	281.93489	140.0
[M-H]-	241.96445	139.9
[M+Na-2H]-	263.94640	142.0
[M]+	242.97118	138.0
[M]-	242.97228	138.0

Literature stripe

literature stripe

Patent stripe

patents stripe