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Benzyl-2,4,6-tri-O-pivaloyl-b-d-ribo-hexopyranoside
SpectraBase Compound ID K1BcUK89NA4
InChI InChI=1S/C28H42O8/c1-26(2,3)23(29)33-17-21-19(35-24(30)27(4,5)6)15-20(36-25(31)28(7,8)9)22(34-21)32-16-18-13-11-10-12-14-18/h10-14,19-22H,15-17H2,1-9H3/t19-,20-,21-,22+/m0/s1
InChIKey XNFAPABSWWZMID-MYGLTJDJSA-N
Mol Weight 506.6 g/mol
Molecular Formula C28H42O8
Exact Mass 506.287968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IK47rPKUyOG
Name Benzyl-2,4,6-tri-o-pivaloyl-B-D-ribo-hexopyranoside
Comments Computed using HOSE algorithm
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Exact Mass 506.287968304 u
Formula C28H42O8
InChI InChI=1S/C28H42O8/c1-26(2,3)23(29)33-17-21-19(35-24(30)27(4,5)6)15-20(36-25(31)28(7,8)9)22(34-21)32-16-18-13-11-10-12-14-18/h10-14,19-22H,15-17H2,1-9H3/t19-,20-,21-,22+/m0/s1
InChIKey XNFAPABSWWZMID-MYGLTJDJSA-N
Molecular Weight 506.636 g/mol
SMILES [C@@]1([C@@](O[C@]([C@](C1)(OC(C(C)(C)C)=O)[H])(OCc1ccccc1)[H])(COC(C(C)(C)C)=O)[H])(OC(=O)C(C)(C)C)[H]