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dipropyl 3-ethoxycarbonyl-6-methylbenzylphosphonate
SpectraBase Compound ID UjYmbrryFH
InChI InChI=1S/C17H27O5P/c1-5-10-21-23(19,22-11-6-2)13-16-12-15(9-8-14(16)4)17(18)20-7-3/h8-9,12H,5-7,10-11,13H2,1-4H3
InChIKey SLHHDQHWBJZZLZ-UHFFFAOYSA-N
Mol Weight 342.37 g/mol
Molecular Formula C17H27O5P
Exact Mass 342.159611 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1WJlYYiU64D
Name dipropyl 3-ethoxycarbonyl-6-methylbenzylphosphonate
Alternate Name(s) Ethyl 3-[(dipropoxyphosphoryl)methyl]-4-methylbenzoate
CAS Registry Number 126613-74-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27O5P
InChI InChI=1S/C17H27O5P/c1-5-10-21-23(19,22-11-6-2)13-16-12-15(9-8-14(16)4)17(18)20-7-3/h8-9,12H,5-7,10-11,13H2,1-4H3
InChIKey SLHHDQHWBJZZLZ-UHFFFAOYSA-N
Molecular Weight 342.372 g/mol
SMILES C(P(=O)(OCCC)OCCC)c1cc(C(=O)OCC)ccc1C
SPLASH splash10-02aj-0490000000-eeb34e05a61a018c6a31
Source of Spectrum K-123-1385-3
Wiley ID 1336401