CID 24832089

28588-76-3

Structural Information

Molecular Formula

C₁₀H₁₀O₂S₄

SMILES

CC1=C(C=CO1)SSSSC2=C(OC=C2)C

InChI

InChI=1S/C10H10O2S4/c1-7-9(3-5-11-7)13-15-16-14-10-4-6-12-8(10)2/h3-6H,1-2H3

InChIKey

WCQMHJWTXQMUQE-UHFFFAOYSA-N

Compound name

2-methyl-3-[(2-methylfuran-3-yl)tetrasulfanyl]furan

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 0
References: 91
Patents: 289.95636 Da
Monoisotopic Mass: 3.8
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]+	290.96364	161.4
[M+Na]+	312.94558	174.5
[M-H]-	288.94908	169.4
[M+NH4]+	307.99018	179.2
[M+K]+	328.91952	169.1
[M+H-H2O]+	272.95362	158.4
[M+HCOO]-	334.95456	167.6
[M+CH3COO]-	348.97021	173.8
[M+Na-2H]-	310.93103	160.4
[M]+	289.95581	167.0
[M]-	289.95691	167.0

Literature stripe

literature stripe

Patent stripe

patents stripe