CID 9576712

14371-55-2

Structural Information

Molecular Formula
C5H10NO3PS2
SMILES
COP(=S)(/N=C/1\OCCS1)OC
InChI
InChI=1S/C5H10NO3PS2/c1-7-10(11,8-2)6-5-9-3-4-12-5/h3-4H2,1-2H3/b6-5+
InChIKey
ZXSAZCMRKXDRJV-AATRIKPKSA-N
Compound name
(E)-N-dimethoxyphosphinothioyl-1,3-oxathiolan-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.98398 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.99126 144.4
[M+Na]+ 249.97320 151.0
[M+NH4]+ 245.01780 151.9
[M+K]+ 265.94714 145.8
[M-H]- 225.97670 145.8
[M+Na-2H]- 247.95865 145.9
[M]+ 226.98343 146.3
[M]- 226.98453 146.3
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.