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DIISOPROPYL_(2-IODOBENZYL)-PHOSPHOROTHIOATE
SpectraBase Compound ID Kdhb3RAfyET
InChI InChI=1S/C13H20IO3PS/c1-10(2)16-18(15,17-11(3)4)19-9-12-7-5-6-8-13(12)14/h5-8,10-11H,9H2,1-4H3
InChIKey GYFBAUYFKNAVTG-UHFFFAOYSA-N
Mol Weight 414.24 g/mol
Molecular Formula C13H20IO3PS
Exact Mass 413.991548 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ZR99KJ8XwM
Name Diisopropyl(2-iodobenzyl)phosphorothioate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20IO3PS
InChI InChI=1S/C13H20IO3PS/c1-10(2)16-18(15,17-11(3)4)19-9-12-7-5-6-8-13(12)14/h5-8,10-11H,9H2,1-4H3
InChIKey GYFBAUYFKNAVTG-UHFFFAOYSA-N
Instrument Name Saturn 2000
Ionization Type EI
Literature Reference DOI 10.1021/jm100213c
Molecular Weight 414.238 g/mol
SMILES c1cc(c(cc1)I)CSP(=O)(OC(C)C)OC(C)C
SPLASH splash10-014r-2240900000-c32a10bc6f1df23c5f7a
Source of Spectrum AF-53-SM4-9
Wiley ID 1846169