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trans-3-(3-Methoxy-4-benzyloxybenzyl)-4-(3-methoxy-4-benzyloxybenzyl).gamma.-butyrolactone
SpectraBase Compound ID 4YBBWdCAED2
InChI InChI=1S/C34H32O7/c1-37-31-18-25(13-15-28(31)39-21-23-9-5-3-6-10-23)17-30-27(20-33(35)41-30)34(36)26-14-16-29(32(19-26)38-2)40-22-24-11-7-4-8-12-24/h3-16,18-19,27,30H,17,20-22H2,1-2H3/t27-,30+/m1/s1
InChIKey IBJXFQXKDSMCRH-OFSOJUDTSA-N
Mol Weight 552.6 g/mol
Molecular Formula C34H32O7
Exact Mass 552.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EpdSxlxv5Jj
Name trans-3-(3-Methoxy-4-benzyloxybenzyl)-4-(3-methoxy-4-benzyloxybenzyl).gamma.-butyrolactone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32O7
InChI InChI=1S/C34H32O7/c1-37-31-18-25(13-15-28(31)39-21-23-9-5-3-6-10-23)17-30-27(20-33(35)41-30)34(36)26-14-16-29(32(19-26)38-2)40-22-24-11-7-4-8-12-24/h3-16,18-19,27,30H,17,20-22H2,1-2H3/t27-,30+/m1/s1
InChIKey IBJXFQXKDSMCRH-OFSOJUDTSA-N
Molecular Weight 552.623 g/mol
SMILES [C@]1([C@@](OC(C1)=O)(Cc1cc(OC)c(cc1)OCc1ccccc1)[H])(C(c1cc(OC)c(cc1)OCc1ccccc1)=O)[H]
SPLASH splash10-0udi-0000090000-b75c3dc2deb74cb84710
Source of Spectrum PS-0-2751-8
Synonyms trans-3-(3-Methoxy-4-benzyloxybenzoyl)-4-(3-methoxy-4-benzyloxybenzyl).gamma.-butyrolactone
Wiley ID 786841