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[1,1'-Biphenyl]-3-octanol, .alpha.-heptyl-3',4,4',5-tetramethoxy-5'-pentadecyl-
SpectraBase Compound ID LJQEfgB3ui9
InChI InChI=1S/C46H78O5/c1-7-9-11-13-14-15-16-17-18-19-20-23-26-30-38-34-40(36-43(48-3)45(38)50-5)41-35-39(46(51-6)44(37-41)49-4)31-27-24-21-25-29-33-42(47)32-28-22-12-10-8-2/h34-37,42,47H,7-33H2,1-6H3
InChIKey QKDIBSGUJSDERS-UHFFFAOYSA-N
Mol Weight 711.1 g/mol
Molecular Formula C46H78O5
Exact Mass 710.584926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ms9Faxb70O
Name [1,1'-Biphenyl]-3-octanol, .alpha.-heptyl-3',4,4',5-tetramethoxy-5'-pentadecyl-
Alternate Name(s) 1-(3',4,4',5-tetramethoxy-5'-pentadecyl[1,1'-biphenyl]-3-yl)-8-pentadecanol 3,4,3',4'-Tetramethoxy-5-pentadecyl-5'-(8-hydroxypentadecyl)biphenyl
CAS Registry Number 97072-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H78O5
InChI InChI=1S/C46H78O5/c1-7-9-11-13-14-15-16-17-18-19-20-23-26-30-38-34-40(36-43(48-3)45(38)50-5)41-35-39(46(51-6)44(37-41)49-4)31-27-24-21-25-29-33-42(47)32-28-22-12-10-8-2/h34-37,42,47H,7-33H2,1-6H3
InChIKey QKDIBSGUJSDERS-UHFFFAOYSA-N
Molecular Weight 711.125 g/mol
SMILES OC(CCCCCCCc1cc(-c2cc(OC)c(c(c2)CCCCCCCCCCCCCCC)OC)cc(OC)c1OC)CCCCCCC
SPLASH splash10-0900-9010000400-5a74fa89f909f2e3bc29
Source of Spectrum J-50-2621-17
Wiley ID 1415369