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(1S)-4-exo-1,4-Dihydroxy-3-exo-[[[bis(phenyloxy)phosphinyl]oxy]methyl]-6-oxabicyclo[3.2.1]octan-7-one
SpectraBase Compound ID B2NRgBYknYb
InChI InChI=1S/C20H21O8P/c21-18-14(11-20(23)12-17(18)26-19(20)22)13-25-29(24,27-15-7-3-1-4-8-15)28-16-9-5-2-6-10-16/h1-10,14,17-18,21,23H,11-13H2/t14-,17+,18+,20-/m0/s1
InChIKey NIKWZKPMEILWBJ-IVGZAAIESA-N
Mol Weight 420.35 g/mol
Molecular Formula C20H21O8P
Exact Mass 420.097405 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EBpqal0JyUv
Name (1S)-4-exo-1,4-Dihydroxy-3-exo-[[[bis(phenyloxy)phosphinyl]oxy]methyl]-6-oxabicyclo[3.2.1]octan-7-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21O8P
InChI InChI=1S/C20H21O8P/c21-18-14(11-20(23)12-17(18)26-19(20)22)13-25-29(24,27-15-7-3-1-4-8-15)28-16-9-5-2-6-10-16/h1-10,14,17-18,21,23H,11-13H2/t14-,17+,18+,20-/m0/s1
InChIKey NIKWZKPMEILWBJ-IVGZAAIESA-N
Molecular Weight 420.354 g/mol
SMILES O[C@]1([C@@]2(OC([C@@](C2)(C[C@]1(COP(Oc1ccccc1)(Oc1ccccc1)=O)[H])O)=O)[H])[H]
SPLASH splash10-0udi-0090000000-b28acd054082f25e27ea
Source of Spectrum J-59-7004-15
Wiley ID 1402831