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(1R),(2E)-Dibutyl-1-hydroxy-2-methyl-3-phenylallylphosphonate
SpectraBase Compound ID EHfLyB1vFUF
InChI InChI=1S/C18H29O4P/c1-4-6-13-21-23(20,22-14-7-5-2)18(19)16(3)15-17-11-9-8-10-12-17/h8-12,15,18-19H,4-7,13-14H2,1-3H3/b16-15+/t18-/m1/s1
InChIKey HKEBTABZKPEAGN-WXWBBQJKSA-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 EBjdMWN4LZu
Name (1R),(2E)-Dibutyl-1-hydroxy-2-methyl-3-phenylallylphosphonate
Alternate Name(s) (R,E)-dibutyl (1-hydroxy-2-methyl-3-phenylallyl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29O4P
InChI InChI=1S/C18H29O4P/c1-4-6-13-21-23(20,22-14-7-5-2)18(19)16(3)15-17-11-9-8-10-12-17/h8-12,15,18-19H,4-7,13-14H2,1-3H3/b16-15+/t18-/m1/s1
InChIKey HKEBTABZKPEAGN-WXWBBQJKSA-N
Literature Reference DOI 10.1002/adsc.201300653
Molecular Weight 340.400 g/mol
SMILES O[C@@](\C(=C\c1ccccc1)C)(P(OCCCC)(OCCCC)=O)[H]
SPLASH splash10-001r-8902000000-dc7cd9a150f27e5b743f
Source of Spectrum ASC-355-3443/SM10-43a
Wiley ID 1761841