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4H-Pyran-4-one, 3-(benzoyloxy)-2,3-dihydro-2-methoxy-6-[(triphenylmethoxy)methyl]-, (2S-cis-)-
SpectraBase Compound ID 5smZIEvBQQM
InChI InChI=1S/C33H28O6/c1-36-32-30(39-31(35)24-14-6-2-7-15-24)29(34)22-28(38-32)23-37-33(25-16-8-3-9-17-25,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-22,30,32H,23H2,1H3/t30-,32+/m1/s1
InChIKey QJISDBLARSUVML-BHYZAODMSA-N
Mol Weight 520.6 g/mol
Molecular Formula C33H28O6
Exact Mass 520.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExtkJD9vowd
Name 4H-Pyran-4-one, 3-(benzoyloxy)-2,3-dihydro-2-methoxy-6-[(triphenylmethoxy)methyl]-, (2S-cis-)-
CAS Registry Number 68325-74-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H28O6
InChI InChI=1S/C33H28O6/c1-36-32-30(39-31(35)24-14-6-2-7-15-24)29(34)22-28(38-32)23-37-33(25-16-8-3-9-17-25,26-18-10-4-11-19-26)27-20-12-5-13-21-27/h2-22,30,32H,23H2,1H3/t30-,32+/m1/s1
InChIKey QJISDBLARSUVML-BHYZAODMSA-N
Molecular Weight 520.581 g/mol
SMILES [C@@]1(C(C=C(O[C@@]1(OC)[H])COC(c1ccccc1)(c1ccccc1)c1ccccc1)=O)(OC(=O)c1ccccc1)[H]
SPLASH splash10-0a4l-0970100000-426f80abf8fa72635ac0
Source of Spectrum I-56-2226-0
Synonyms (2S,3S)-2-methoxy-4-oxo-6-[(trityloxy)methyl]-3,4-dihydro-2H-pyran-3-yl benzoate Mixture of methyl 2-O-benzoyl-4-deoxy-6-O-triphenylmethyl-.alpha.-D-glycerohex-4-enopyranosid-3-ulose and .beta.-L isomer
Wiley ID 1402040