CID 10902862

Diphenyldithioperoxyanhydride

Structural Information

Molecular Formula

C₁₄H₁₀S₄

SMILES

C1=CC=C(C=C1)C(=S)SSC(=S)C2=CC=CC=C2

InChI

InChI=1S/C14H10S4/c15-13(11-7-3-1-4-8-11)17-18-14(16)12-9-5-2-6-10-12/h1-10H

InChIKey

LWGLGSPYKZTZBM-UHFFFAOYSA-N

Compound name

benzenecarbonothioylsulfanyl benzenecarbodithioate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1670
Patents: 305.96652 Da
Monoisotopic Mass: 5.0
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]+	306.97380	152.8
[M+Na]+	328.95574	164.4
[M+NH4]+	324.00034	162.8
[M+K]+	344.92968	150.9
[M-H]-	304.95924	158.1
[M+Na-2H]-	326.94119	159.7
[M]+	305.96597	157.9
[M]-	305.96707	157.9

Literature stripe

literature stripe

Patent stripe

patents stripe