CID 24019
Brn 5583594
Structural Information
- Molecular Formula
- C13H19O5PS
- SMILES
- CCOC(=O)C1=CC=CC=C1OP(=S)(OCC)OCC
- InChI
- InChI=1S/C13H19O5PS/c1-4-15-13(14)11-9-7-8-10-12(11)18-19(20,16-5-2)17-6-3/h7-10H,4-6H2,1-3H3
- InChIKey
- YFUHISMUGZGZBH-UHFFFAOYSA-N
- Compound name
- ethyl 2-diethoxyphosphinothioyloxybenzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 319.07638 | 170.6 |
[M+Na]+ | 341.05832 | 176.6 |
[M-H]- | 317.06182 | 172.8 |
[M+NH4]+ | 336.10292 | 186.0 |
[M+K]+ | 357.03226 | 175.2 |
[M+H-H2O]+ | 301.06636 | 161.3 |
[M+HCOO]- | 363.06730 | 193.0 |
[M+CH3COO]- | 377.08295 | 204.1 |
[M+Na-2H]- | 339.04377 | 169.7 |
[M]+ | 318.06855 | 180.1 |
[M]- | 318.06965 | 180.1 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.