CID 77395

Monsanto cp-13206

Structural Information

Molecular Formula
C10H24O4P2S5
SMILES
CCOP(=S)(OCC)SCSCSP(=S)(OCC)OCC
InChI
InChI=1S/C10H24O4P2S5/c1-5-11-15(17,12-6-2)20-9-19-10-21-16(18,13-7-3)14-8-4/h5-10H2,1-4H3
InChIKey
XAPFNRDTCIXDLS-UHFFFAOYSA-N
Compound name
diethoxyphosphinothioylsulfanylmethylsulfanylmethylsulfanyl-diethoxy-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.97534 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.98262 188.1
[M+Na]+ 452.96456 189.4
[M-H]- 428.96806 181.2
[M+NH4]+ 448.00916 196.6
[M+K]+ 468.93850 178.9
[M+H-H2O]+ 412.97260 173.9
[M+HCOO]- 474.97354 192.2
[M+CH3COO]- 488.98919 223.2
[M+Na-2H]- 450.95001 185.5
[M]+ 429.97479 187.5
[M]- 429.97589 187.5
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.