CID 163471

Phosphoramidodithioic acid, ethylformyl-, o-ethyl s-(1-methylpropyl) ester

Structural Information

Molecular Formula
C9H20NO2PS2
SMILES
CCC(C)SP(=S)(N(CC)C=O)OCC
InChI
InChI=1S/C9H20NO2PS2/c1-5-9(4)15-13(14,12-7-3)10(6-2)8-11/h8-9H,5-7H2,1-4H3
InChIKey
OBZUTJUCLUGNMG-UHFFFAOYSA-N
Compound name
N-[butan-2-ylsulfanyl(ethoxy)phosphinothioyl]-N-ethylformamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

269.06732 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.07460 159.8
[M+Na]+ 292.05654 165.7
[M+NH4]+ 287.10114 166.2
[M+K]+ 308.03048 158.5
[M-H]- 268.06004 158.3
[M+Na-2H]- 290.04199 160.0
[M]+ 269.06677 160.8
[M]- 269.06787 160.8
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