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BISGRAVILLOL;1-O-METHYL-5-[14''-(1',3'-DIHYDROXYPHENYL)-TETRADEC-1''-YL]-RESORCINOL
SpectraBase Compound ID DR11DHeJ6U8
InChI InChI=1S/C27H40O4/c1-31-27-19-23(18-26(30)21-27)15-13-11-9-7-5-3-2-4-6-8-10-12-14-22-16-24(28)20-25(29)17-22/h16-21,28-30H,2-15H2,1H3
InChIKey HACJVLBLYFAKNF-UHFFFAOYSA-N
Mol Weight 428.6 g/mol
Molecular Formula C27H40O4
Exact Mass 428.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lr4NbgC6mP
Name 1-O-Methyl5-{14"-(1',3'-dihydroxyphenyl)tetradec-1'-yl]resorcinol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40O4
InChI InChI=1S/C27H40O4/c1-31-27-19-23(18-26(30)21-27)15-13-11-9-7-5-3-2-4-6-8-10-12-14-22-16-24(28)20-25(29)17-22/h16-21,28-30H,2-15H2,1H3
InChIKey HACJVLBLYFAKNF-UHFFFAOYSA-N
Molecular Weight 428.613 g/mol
SMILES Oc1cc(cc(c1)CCCCCCCCCCCCCCc1cc(O)cc(c1)OC)O
SPLASH splash10-002r-0900300000-0f8459020c98430723b5
Source of Spectrum G4-70-322-3
Synonyms 1-(3'-Hydroxy-5'-methoxyphenyl)-14-(3'',5''-dihydroxyphenyl)tetradecane Bis-gravilliol 5-[14-(3-hydroxy-5-methoxyphenyl)tetradecyl]benzene-1,3-diol 5-[14-(3-hydroxy-5-methoxy-phenyl)tetradecyl]benzene-1,3-diol 5-[14-(3-methoxy-5-oxidanyl-phenyl)tetradecyl]benzene-1,3-diol
Wiley ID 1694684