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(2S,3R,4Z,6S,7R,1'E/Z)-3-Benzyloxy-2-benzyloxymethyl-6-(4-methoxybenzyloxy)-7-(2'-methoxvinyl)-2,3,6,7-tetrahydrooxepin
SpectraBase Compound ID DB0Uqacn0fF
InChI InChI=1S/C32H36O6/c1-33-20-19-31-29(36-23-27-13-15-28(34-2)16-14-27)17-18-30(37-22-26-11-7-4-8-12-26)32(38-31)24-35-21-25-9-5-3-6-10-25/h3-20,29-32H,21-24H2,1-2H3/t29-,30+,31+,32-/m0/s1
InChIKey NIVRQIIQMXZNKK-BVEPWEIPSA-N
Mol Weight 516.6 g/mol
Molecular Formula C32H36O6
Exact Mass 516.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cj61tQo7DYs
Name (2S,3R,4Z,6S,7R,1'E/Z)-3-Benzyloxy-2-benzyloxymethyl-6-(4-methoxybenzyloxy)-7-(2'-methoxvinyl)-2,3,6,7-tetrahydrooxepin
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36O6
InChI InChI=1S/C32H36O6/c1-33-20-19-31-29(36-23-27-13-15-28(34-2)16-14-27)17-18-30(37-22-26-11-7-4-8-12-26)32(38-31)24-35-21-25-9-5-3-6-10-25/h3-20,29-32H,21-24H2,1-2H3/t29-,30+,31+,32-/m0/s1
InChIKey NIVRQIIQMXZNKK-BVEPWEIPSA-N
Molecular Weight 516.634 g/mol
SMILES [C@@]1(O[C@@]([C@](C=C[C@]1(OCc1ccccc1)[H])(OCc1ccc(cc1)OC)[H])(C=COC)[H])(COCc1ccccc1)[H]
SPLASH splash10-0002-0009000000-78c349d948186dd115b1
Source of Spectrum KC-61-7411-73
Wiley ID 1629975