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(2S,3S,4S,5R,6S)-2-(bromomethyl)-6-methoxy-3,4,5-tris(phenylmethoxy)oxane
SpectraBase Compound ID 4XhVVNGtF6f
InChI InChI=1S/C28H31BrO5/c1-30-28-27(33-20-23-15-9-4-10-16-23)26(32-19-22-13-7-3-8-14-22)25(24(17-29)34-28)31-18-21-11-5-2-6-12-21/h2-16,24-28H,17-20H2,1H3/t24-,25-,26+,27-,28+/m1/s1
InChIKey GBRWKBAOTRGDCL-DFLSAPQXSA-N
Mol Weight 527.46 g/mol
Molecular Formula C28H31BrO5
Exact Mass 526.135487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LW4RfKqPt4k
Name (2S,3S,4S,5R,6S)-2-(bromomethyl)-6-methoxy-3,4,5-tris(phenylmethoxy)oxane
Alternate Name(s) (2S,3S,4S,5R,6S)-3,4,5-tribenzoxy-2-(bromomethyl)-6-methoxy-tetrahydropyran (2S,3S,4S,5R,6S)-3,4,5-tribenzyloxy-2-(bromomethyl)-6-methoxy-tetrahydropyran
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Formula C28H31BrO5
InChI InChI=1S/C28H31BrO5/c1-30-28-27(33-20-23-15-9-4-10-16-23)26(32-19-22-13-7-3-8-14-22)25(24(17-29)34-28)31-18-21-11-5-2-6-12-21/h2-16,24-28H,17-20H2,1H3/t24-,25-,26+,27-,28+/m1/s1
InChIKey GBRWKBAOTRGDCL-DFLSAPQXSA-N
Molecular Weight 527.455 g/mol
SMILES [C@@]1([C@]([C@](OCc2ccccc2)([C@](O[C@@]1(OC)[H])(CBr)[H])[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H]
SPLASH splash10-0006-9000000000-6038a0876f32b486df57
Source of Spectrum H-62-2003-0
Wiley ID 1402814