CID 77530

Thiophosphoryl bromide

Structural Information

Molecular Formula

SMILES

P(=S)(Br)(Br)Br

InChI

InChI=1S/Br3PS/c1-4(2,3)5

InChIKey

OWNZHTHZRZVKSQ-UHFFFAOYSA-N

Compound name

tribromo(sulfanylidene)-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 472
Patents: 299.70084 Da
Monoisotopic Mass: 4.0
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]+	300.70812	131.6
[M+Na]+	322.69006	142.3
[M-H]-	298.69356	135.8
[M+NH4]+	317.73466	148.9
[M+K]+	338.66400	125.5
[M+H-H2O]+	282.69810	145.8
[M+HCOO]-	344.69904	142.1
[M+CH3COO]-	358.71469	212.9
[M+Na-2H]-	320.67551	136.1
[M]+	299.70029	172.6
[M]-	299.70139	172.6

Literature stripe

literature stripe

Patent stripe

patents stripe