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Phosalone
SpectraBase Compound ID T8iR7eqTWC
InChI InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3
InChIKey IOUNQDKNJZEDEP-UHFFFAOYSA-N
Mol Weight 367.8 g/mol
Molecular Formula C12H15ClNO4PS2
Exact Mass 366.986865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mPiuxRB2ph
Name Phosalone
Carrier Gas Helium (1.0 ml/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15ClNO4PS2
GC Column Agilent VF 17 (30 m x 0.250 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 270oC
InChI InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3
InChIKey IOUNQDKNJZEDEP-UHFFFAOYSA-N
Inlet Type Splitless
Instrument Name Agilent 6890N-5975
Ionization Type EI
Literature Reference DOI 10.1002/jssc.201601337
Molecular Weight 367.802 g/mol
Quality 35
SMILES C(SP(OCC)(OCC)=S)N1C(OC2=C1C=CC(=C2)Cl)=O
SPLASH splash10-001i-0903000000-7dbacfe54a390497326b
Source of Spectrum SEP-40-2441-Phosalone (DOI: 10.1002/jssc.201601337)
Wiley ID 1904390