SpectraBase Spectrum ID |
DmOdnyZUqB6 |
Name |
Parathion-isomer (P=O) |
Classification |
E605 by-product |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
291.033030722 u |
Formula |
C10H14NO5PS |
InChI |
InChI=1S/C10H14NO5PS/c1-3-15-17(14,16-4-2)18-10-7-5-9(6-8-10)11(12)13/h5-8H,3-4H2,1-2H3 |
InChIKey |
DSVCXDBXXBVSEB-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
291.258 g/mol |
Nominal Mass |
291 u |
Quality |
986 |
Retention Index |
2131 |
SMILES |
C1(SP(OCC)(OCC)=O)=CC=C([N+](=O)[O-])C=C1 |
SPLASH |
splash10-004v-4910000000-d4a6eeb143a3a1b109fe |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
O,O-Diethyl,S-(p-nitrophenyl)phosphorothioate |
Technique |
GC/MS |
Wiley ID |
DD2024_012546 |