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Diethyl (1-phenylthiooct-3-en-1-yl)phosphonate
SpectraBase Compound ID 30mqSyhqXUn
InChI InChI=1S/C18H29O3PS/c1-4-7-8-9-13-16-18(22(19,20-5-2)21-6-3)23-17-14-11-10-12-15-17/h9-15,18H,4-8,16H2,1-3H3/b13-9+
InChIKey BYYGVCCBYHJRNJ-UKTHLTGXSA-N
Mol Weight 356.46 g/mol
Molecular Formula C18H29O3PS
Exact Mass 356.157503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCmjdCBlzYr
Name Diethyl (1-phenylthiooct-3-en-1-yl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29O3PS
InChI InChI=1S/C18H29O3PS/c1-4-7-8-9-13-16-18(22(19,20-5-2)21-6-3)23-17-14-11-10-12-15-17/h9-15,18H,4-8,16H2,1-3H3/b13-9+
InChIKey BYYGVCCBYHJRNJ-UKTHLTGXSA-N
Molecular Weight 356.461 g/mol
SMILES C(P(=O)(OCC)OCC)(Sc1ccccc1)C\C=C\CCCC
SPLASH splash10-0ir1-0490000000-82e02c7e028c5182fcfc
Source of Spectrum QB-18-251-2
Synonyms Diethyl (3E)-1-(phenylsulfanyl)-3-octenylphosphonate
Wiley ID 841762