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dipropyl (2-methoxycarbonyl-6-methylbenzyl)phosphonate
SpectraBase Compound ID 1lrlP8lrVGC
InChI InChI=1S/C16H25O5P/c1-5-10-20-22(18,21-11-6-2)12-15-13(3)8-7-9-14(15)16(17)19-4/h7-9H,5-6,10-12H2,1-4H3
InChIKey ORMJQFVEVXWUEM-UHFFFAOYSA-N
Mol Weight 328.34 g/mol
Molecular Formula C16H25O5P
Exact Mass 328.143961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BQ03RdFnMHN
Name dipropyl (2-methoxycarbonyl-6-methylbenzyl)phosphonate
Alternate Name(s) Methyl 2-[(dipropoxyphosphoryl)methyl]-3-methylbenzoate
CAS Registry Number 126579-01-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25O5P
InChI InChI=1S/C16H25O5P/c1-5-10-20-22(18,21-11-6-2)12-15-13(3)8-7-9-14(15)16(17)19-4/h7-9H,5-6,10-12H2,1-4H3
InChIKey ORMJQFVEVXWUEM-UHFFFAOYSA-N
Molecular Weight 328.345 g/mol
SMILES C(P(=O)(OCCC)OCCC)c1c(C(=O)OC)cccc1C
SPLASH splash10-01q9-0960000000-ff28d150754c35fd68c9
Source of Spectrum K-123-1385-4
Wiley ID 1326060