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dipropyl 2-ethoxycarbonyl-6-methylbenzylphosphonate
SpectraBase Compound ID 1YRpczpJTHB
InChI InChI=1S/C17H27O5P/c1-5-11-21-23(19,22-12-6-2)13-16-14(4)9-8-10-15(16)17(18)20-7-3/h8-10H,5-7,11-13H2,1-4H3
InChIKey SPPNAGACNGOXST-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 D6KADgRLPuA
Name dipropyl 2-ethoxycarbonyl-6-methylbenzylphosphonate
Alternate Name(s) Ethyl 2-[(dipropoxyphosphoryl)methyl]-3-methylbenzoate
CAS Registry Number 126579-04-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27O5P
InChI InChI=1S/C17H27O5P/c1-5-11-21-23(19,22-12-6-2)13-16-14(4)9-8-10-15(16)17(18)20-7-3/h8-10H,5-7,11-13H2,1-4H3
InChIKey SPPNAGACNGOXST-UHFFFAOYSA-N
Molecular Weight 342.372 g/mol
SMILES C(P(=O)(OCCC)OCCC)c1c(C(=O)OCC)cccc1C
SPLASH splash10-01qa-1890000000-62fa10cc12a269947e08
Source of Spectrum K-123-1385-4
Wiley ID 1336402