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Diethyl (2RS,3S)-(+)-(2-Isopropyl-3-methyl-4-oxo-4-phenylbutyl)phosphonate
SpectraBase Compound ID 1d431OC7AY4
InChI InChI=1S/C18H29O4P/c1-6-21-23(20,22-7-2)13-17(14(3)4)15(5)18(19)16-11-9-8-10-12-16/h8-12,14-15,17H,6-7,13H2,1-5H3/t15-,17+/m0/s1
InChIKey PIQRKQPMJAEEQE-DOTOQJQBSA-N
Mol Weight 340.4 g/mol
Molecular Formula C18H29O4P
Exact Mass 340.180346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQgcU4zzz1I
Name Diethyl (2RS,3S)-(+)-(2-Isopropyl-3-methyl-4-oxo-4-phenylbutyl)phosphonate
Alternate Name(s) Diethyl (2R,3S)-2-isopropyl-3-methyl-4-oxo-4-phenylbutylphosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29O4P
InChI InChI=1S/C18H29O4P/c1-6-21-23(20,22-7-2)13-17(14(3)4)15(5)18(19)16-11-9-8-10-12-16/h8-12,14-15,17H,6-7,13H2,1-5H3/t15-,17+/m0/s1
InChIKey PIQRKQPMJAEEQE-DOTOQJQBSA-N
Molecular Weight 340.400 g/mol
SMILES C(P(=O)(OCC)OCC)[C@@]([C@@](C(=O)c1ccccc1)(C)[H])(C(C)C)[H]
SPLASH splash10-0a4i-0190000000-95c4c32954537c0df3fa
Source of Spectrum F-53-12973-5
Wiley ID 803763