CID 23734

Potassium decylxanthate

Structural Information

Molecular Formula
C11H22OS2
SMILES
CCCCCCCCCCOC(=S)S
InChI
InChI=1S/C11H22OS2/c1-2-3-4-5-6-7-8-9-10-12-11(13)14/h2-10H2,1H3,(H,13,14)
InChIKey
QMPPYLFXRKUTOR-UHFFFAOYSA-N
Compound name
decoxymethanedithioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

313
Patents

234.1112 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.11848 155.2
[M+Na]+ 257.10042 163.4
[M+NH4]+ 252.14502 163.2
[M+K]+ 273.07436 153.0
[M-H]- 233.10392 155.1
[M+Na-2H]- 255.08587 156.1
[M]+ 234.11065 157.1
[M]- 234.11175 157.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe