| SpectraBase Spectrum ID |
6wA8Ste4wTz |
| Name |
Phosalone impurity |
| Classification |
Insecticide |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
400.947892677 u |
| Formula |
C12H14Cl2NO4PS2 |
| InChI |
InChI=1S/C12H14Cl2NO4PS2/c1-3-17-20(21,18-4-2)22-7-15-9-6-5-8(13)10(14)11(9)19-12(15)16/h5-6H,3-4,7H2,1-2H3 |
| InChIKey |
GLBHEWDZFPIVAA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
402.247 g/mol |
| SMILES |
c1(c(c2c(N(CSP(OCC)(OCC)=S)C(=O)O2)cc1)Cl)Cl |
| SPLASH |
splash10-0gb9-1950200000-24f94c8e486171714aa9 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: G |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Phosalone impurity (dichloro-) |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_6365 |
