| SpectraBase Spectrum ID |
3QptWyDdWC |
| Name |
Parathion |
| CAS Registry Number |
56-38-2 |
| Classification |
Acaricide, insecticide |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
291.033030722 u |
| Formula |
C10H14NO5PS |
| InChI |
InChI=1S/C10H14NO5PS/c1-3-14-17(18,15-4-2)16-10-7-5-9(6-8-10)11(12)13/h5-8H,3-4H2,1-2H3 |
| InChIKey |
LCCNCVORNKJIRZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
291.258 g/mol |
| Nominal Mass |
291 u |
| Quality |
996 |
| Retention Index |
1942 |
| SMILES |
C1(OP(OCC)(OCC)=S)=CC=C([N+](=O)[O-])C=C1 |
| SPLASH |
splash10-0a4s-7920000000-039ddee516ae52700af3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
E 605
Parathion-Ethyl
O,O-Diethyl-O''-(4-nitrophenyl)phosphate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019287 |
