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Methyl 3-((diethoxyphosphoryl)(1,3-dithiepan-2-ylidene)methyl)isoxazole-5-carboxylate
SpectraBase Compound ID Hwz3Uo9qlcr
InChI InChI=1S/C15H22NO6PS2/c1-4-20-23(18,21-5-2)13(15-24-8-6-7-9-25-15)11-10-12(22-16-11)14(17)19-3/h10H,4-9H2,1-3H3
InChIKey WBBSOEMABSCFND-UHFFFAOYSA-N
Mol Weight 407.44 g/mol
Molecular Formula C15H22NO6PS2
Exact Mass 407.062617 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 174MlkSjl6k
Name Methyl 3-((diethoxyphosphoryl)(1,3-dithiepan-2-ylidene)methyl)isoxazole-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22NO6PS2
InChI InChI=1S/C15H22NO6PS2/c1-4-20-23(18,21-5-2)13(15-24-8-6-7-9-25-15)11-10-12(22-16-11)14(17)19-3/h10H,4-9H2,1-3H3
InChIKey WBBSOEMABSCFND-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19923340511
Molecular Weight 407.436 g/mol
SMILES C(P(OCC)(OCC)=O)(c1cc(on1)C(=O)OC)=C1SCCCCS1
SPLASH splash10-00di-0159000000-b8c2d2e7d5fca119aa01
Source of Spectrum JF-334-433-6b
Wiley ID 1791849