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(2R,3S,4Z,6R,7S)-{6-Benzyloxy-7-benzyloxymethyl-3-(4-methoxybenzyloxy)-2,3,6,7-tetrahydrooxepin-2-yl}ethanal
SpectraBase Compound ID 35UNlTq1Ds9
InChI InChI=1S/C31H34O6/c1-33-27-14-12-26(13-15-27)22-35-28-16-17-29(36-21-25-10-6-3-7-11-25)31(37-30(28)18-19-32)23-34-20-24-8-4-2-5-9-24/h2-17,19,28-31H,18,20-23H2,1H3/t28-,29+,30+,31-/m0/s1
InChIKey IHBPOIFNLDHPQU-KQFVITFDSA-N
Mol Weight 502.6 g/mol
Molecular Formula C31H34O6
Exact Mass 502.235539 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoLRrAM3G4k
Name (2R,3S,4Z,6R,7S)-{6-Benzyloxy-7-benzyloxymethyl-3-(4-methoxybenzyloxy)-2,3,6,7-tetrahydrooxepin-2-yl}ethanal
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H34O6
InChI InChI=1S/C31H34O6/c1-33-27-14-12-26(13-15-27)22-35-28-16-17-29(36-21-25-10-6-3-7-11-25)31(37-30(28)18-19-32)23-34-20-24-8-4-2-5-9-24/h2-17,19,28-31H,18,20-23H2,1H3/t28-,29+,30+,31-/m0/s1
InChIKey IHBPOIFNLDHPQU-KQFVITFDSA-N
Molecular Weight 502.607 g/mol
SMILES [C@@]1(O[C@@]([C@](C=C[C@]1(OCc1ccccc1)[H])(OCc1ccc(cc1)OC)[H])(CC=O)[H])(COCc1ccccc1)[H]
SPLASH splash10-0a4i-0090000000-2fcb4cc809bfd427da3d
Source of Spectrum KC-61-7412-74
Synonyms (2R,3S,4Z,6R,7S)-{6-Benzyloxy-2-benzyloxymethyl-3-(4-methoxybenzyloxy)-2,3,6,7-tetrahydrooxepin-2-yl}ethanal 3,8-anhydro-7,9-di-O-benzyl-2,5,6-trideoxy-4-O-(4-methoxybenzyl)-L-allo-non-5-enose
Wiley ID 1629974