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bis(Benzyl) 3'-[(benzyloxy)methyl]-5',5'-dimethylhexane-2',4'-diyl diether
SpectraBase Compound ID C1gEOeHnpOP
InChI InChI=1S/C30H38O3/c1-30(2,3)29(32)27(22-33-21-25-17-11-6-12-18-25)28(31)26(19-23-13-7-4-8-14-23)20-24-15-9-5-10-16-24/h4-18,26-29,31-32H,19-22H2,1-3H3
InChIKey IZXBMTGPOFEHEE-UHFFFAOYSA-N
Mol Weight 446.6 g/mol
Molecular Formula C30H38O3
Exact Mass 446.282095 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LtJaf9l0uy1
Name bis(Benzyl) 3'-[(benzyloxy)methyl]-5',5'-dimethylhexane-2',4'-diyl diether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H38O3
InChI InChI=1S/C30H38O3/c1-30(2,3)29(32)27(22-33-21-25-17-11-6-12-18-25)28(31)26(19-23-13-7-4-8-14-23)20-24-15-9-5-10-16-24/h4-18,26-29,31-32H,19-22H2,1-3H3
InChIKey IZXBMTGPOFEHEE-UHFFFAOYSA-N
Molecular Weight 446.631 g/mol
SMILES OC(C(C(C(C)(C)C)O)COCc1ccccc1)C(Cc1ccccc1)Cc1ccccc1
SPLASH splash10-0006-9300000000-d6f5ce18305ae64c6d90
Source of Spectrum H-77-1684-13
Synonyms (2S,3R)-3-Benzyloxy-2-((R)-1-benzyloxy-ethyl)-4,4-dimethyl-pentan-1-ol 2-Benzyl-4-[(benzyloxy)methyl]-6,6-dimethyl-1-phenyl-3,5-heptanediol
Wiley ID 1386843