CID 90502

24441-47-2

Structural Information

Molecular Formula
C10H14ClOPS2
SMILES
CCOP(=S)(CCl)SC1=CC=C(C=C1)C
InChI
InChI=1S/C10H14ClOPS2/c1-3-12-13(14,8-11)15-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3
InChIKey
KSILONBFKOHCMN-UHFFFAOYSA-N
Compound name
chloromethyl-ethoxy-(4-methylphenyl)sulfanyl-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.9912 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.99848 156.9
[M+Na]+ 302.98042 168.7
[M+NH4]+ 298.02502 166.0
[M+K]+ 318.95436 157.9
[M-H]- 278.98392 158.9
[M+Na-2H]- 300.96587 161.8
[M]+ 279.99065 160.4
[M]- 279.99175 160.4
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

No patent data available for this compound.