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7,7'-bis(3-hydroxypropyl)-8,8'-dimethoxy-1,1'-binaphthyl-ditosylate
SpectraBase Compound ID GVsNAgV4R9n
InChI InChI=1S/C42H42O8S2/c1-29-15-23-35(24-16-29)51(43,44)49-27-7-11-33-21-19-31-9-5-13-37(39(31)41(33)47-3)38-14-6-10-32-20-22-34(42(48-4)40(32)38)12-8-28-50-52(45,46)36-25-17-30(2)18-26-36/h5-6,9-10,13-26H,7-8,11-12,27-28H2,1-4H3
InChIKey ADJJNVJVNMMENP-UHFFFAOYSA-N
Mol Weight 738.9 g/mol
Molecular Formula C42H42O8S2
Exact Mass 738.232111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tQDr8lTj9l
Name 7,7'-bis(3-hydroxypropyl)-8,8'-dimethoxy-1,1'-binaphthyl-ditosylate
Alternate Name(s) 3-{1-methoxy-8-[8-methoxy-7-(3-{[(4-methylbenzene)sulfonyl]oxy}propyl)naphthalen-1-yl]naphthalen-2-yl}propyl 4-methylbenzene-1-sulfonate
CAS Registry Number 138155-68-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H42O8S2
InChI InChI=1S/C42H42O8S2/c1-29-15-23-35(24-16-29)51(43,44)49-27-7-11-33-21-19-31-9-5-13-37(39(31)41(33)47-3)38-14-6-10-32-20-22-34(42(48-4)40(32)38)12-8-28-50-52(45,46)36-25-17-30(2)18-26-36/h5-6,9-10,13-26H,7-8,11-12,27-28H2,1-4H3
InChIKey ADJJNVJVNMMENP-UHFFFAOYSA-N
Molecular Weight 738.910 g/mol
SMILES c1(S(=O)(=O)OCCCc2c(c3c(-c4c5c(c(CCCOS(c6ccc(cc6)C)(=O)=O)ccc5ccc4)OC)cccc3cc2)OC)ccc(cc1)C
SPLASH splash10-0006-9500000000-146c7af708559f9a6710
Source of Spectrum K-125-685-14
Wiley ID 1416070