CID 6507086

(3-ethyl-5-methyl-4-oxo-2-oxazolidinylidene)phosphoramidothioic acid o,s-dimethyl ester

Structural Information

Molecular Formula
C8H15N2O4PS
SMILES
CCN\1C(=O)C(O/C1=N/P(=O)(OC)SC)C
InChI
InChI=1S/C8H15N2O4PS/c1-5-10-7(11)6(2)14-8(10)9-15(12,13-3)16-4/h6H,5H2,1-4H3/b9-8+
InChIKey
GHJZWZTVQIOPQE-CMDGGOBGSA-N
Compound name
(2E)-3-ethyl-2-[methoxy(methylsulfanyl)phosphoryl]imino-5-methyl-1,3-oxazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

266.049 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.05628 155.0
[M+Na]+ 289.03822 163.1
[M-H]- 265.04172 158.5
[M+NH4]+ 284.08282 172.6
[M+K]+ 305.01216 163.5
[M+H-H2O]+ 249.04626 146.9
[M+HCOO]- 311.04720 178.2
[M+CH3COO]- 325.06285 198.8
[M+Na-2H]- 287.02367 154.2
[M]+ 266.04845 161.9
[M]- 266.04955 161.9
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.