For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Dimethyl (3R,5R,6S,7S,8R)-6,8-Isopropylidenedioxy-7-methoxy-5-[2-(4-methoxybenzyloxy)ethyl]-3-methyl-2-oxo-10-undecenylphosphonate
SpectraBase Compound ID J7QORN4H1Ez
InChI InChI=1S/C28H45O9P/c1-9-10-25-27(32-6)26(37-28(3,4)36-25)22(17-20(2)24(29)19-38(30,33-7)34-8)15-16-35-18-21-11-13-23(31-5)14-12-21/h9,11-14,20,22,25-27H,1,10,15-19H2,2-8H3/t20-,22+,25-,26+,27+/m1/s1
InChIKey HHXMURGEDUCORR-LVLYNKQKSA-N
Mol Weight 556.6 g/mol
Molecular Formula C28H45O9P
Exact Mass 556.28012 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7wVKnkHbKiI
Name Dimethyl (3R,5R,6S,7S,8R)-6,8-Isopropylidenedioxy-7-methoxy-5-[2-(4-methoxybenzyloxy)ethyl]-3-methyl-2-oxo-10-undecenylphosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H45O9P
InChI InChI=1S/C28H45O9P/c1-9-10-25-27(32-6)26(37-28(3,4)36-25)22(17-20(2)24(29)19-38(30,33-7)34-8)15-16-35-18-21-11-13-23(31-5)14-12-21/h9,11-14,20,22,25-27H,1,10,15-19H2,2-8H3/t20-,22+,25-,26+,27+/m1/s1
InChIKey HHXMURGEDUCORR-LVLYNKQKSA-N
Molecular Weight 556.633 g/mol
SMILES C(P(=O)(OC)OC)C([C@@](C[C@@]([C@@]1(OC(C)(C)O[C@@]([C@@]1(OC)[H])(CC=C)[H])[H])(CCOCc1ccc(cc1)OC)[H])(C)[H])=O
SPLASH splash10-00di-0910000000-6b7f2c73b5e0b92d4643
Source of Spectrum E1-39-71-29
Synonyms (1R)-1-C-allyl-4,5-dideoxy-4-[(2R)-4-(dimethoxyphosphoryl)-2-methyl-3-oxobutyl]-6-O-(4-methoxybenzyl)-2-O-methyl-1,3-O-(1-methylethylidene)-D-xylo-hexitol
Wiley ID 1518629