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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 BqO6bjjbl4g
Name Phosalone
Carrier Gas Helium (20 psi)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15ClNO4PS2
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 280oC
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
Instrument Name Agilent 6890-5973N
Ionization Type EI
Literature Reference DOI 10.1002/jssc.200500250
Molecular Weight 367.802 g/mol
Quality 35
SMILES CCOP(=S)(OCC)SCN1C2=C(C=C(C=C2)Cl)OC1=O
SPLASH splash10-001i-0903000000-fc2802191b821c48f403
Source of Spectrum SEP-29-2335-Phosalone (DOI: 10.1002/jssc.200500250)
Wiley ID 1906168