CID 90384

Tris(2-thienyl)phosphine

Structural Information

Molecular Formula
C12H9PS3
SMILES
C1=CSC(=C1)P(C2=CC=CS2)C3=CC=CS3
InChI
InChI=1S/C12H9PS3/c1-4-10(14-7-1)13(11-5-2-8-15-11)12-6-3-9-16-12/h1-9H
InChIKey
KUCPTMZJPDVWJL-UHFFFAOYSA-N
Compound name
trithiophen-2-ylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

469
Patents

279.9604 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.96768 154.8
[M+Na]+ 302.94962 166.8
[M-H]- 278.95312 165.2
[M+NH4]+ 297.99422 177.8
[M+K]+ 318.92356 162.6
[M+H-H2O]+ 262.95766 148.6
[M+HCOO]- 324.95860 174.5
[M+CH3COO]- 338.97425 168.8
[M+Na-2H]- 300.93507 149.0
[M]+ 279.95985 158.8
[M]- 279.96095 158.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe