CID 184006

Phosphonothioic acid, ethyl-, o,s-dimethyl ester

Structural Information

Molecular Formula
C4H11O2PS
SMILES
CCP(=O)(OC)SC
InChI
InChI=1S/C4H11O2PS/c1-4-7(5,6-2)8-3/h4H2,1-3H3
InChIKey
ZEOAMTWWLDATMW-UHFFFAOYSA-N
Compound name
1-[methoxy(methylsulfanyl)phosphoryl]ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.02174 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.02902 131.3
[M+Na]+ 177.01096 140.6
[M+NH4]+ 172.05556 139.1
[M+K]+ 192.98490 134.3
[M-H]- 153.01446 129.9
[M+Na-2H]- 174.99641 133.8
[M]+ 154.02119 132.5
[M]- 154.02229 132.5
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.