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2-(p-Methoxybenzyl)-2-[(phenylsulfonyloxy)methyl]-1,3-bis[(phenylsulfonyl)oxy]-propane
SpectraBase Compound ID DNFnffJ30Js
InChI InChI=1S/C30H30O10S3/c1-37-26-19-17-25(18-20-26)21-30(22-38-41(31,32)27-11-5-2-6-12-27,23-39-42(33,34)28-13-7-3-8-14-28)24-40-43(35,36)29-15-9-4-10-16-29/h2-20H,21-24H2,1H3
InChIKey MRJNVYCDBYEKKH-UHFFFAOYSA-N
Mol Weight 646.74 g/mol
Molecular Formula C30H30O10S3
Exact Mass 646.100111 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6brZSgpk2x2
Name 2-(p-Methoxybenzyl)-2-[(phenylsulfonyloxy)methyl]-1,3-bis[(phenylsulfonyl)oxy]-propane
Alternate Name(s) 1,3-phenylene-19-crown-6
Comments Less than 3 mono-isotopic peaks
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Formula C30H30O10S3
InChI InChI=1S/C30H30O10S3/c1-37-26-19-17-25(18-20-26)21-30(22-38-41(31,32)27-11-5-2-6-12-27,23-39-42(33,34)28-13-7-3-8-14-28)24-40-43(35,36)29-15-9-4-10-16-29/h2-20H,21-24H2,1H3
InChIKey MRJNVYCDBYEKKH-UHFFFAOYSA-N
Molecular Weight 646.740 g/mol
SMILES C(OS(=O)(=O)c1ccccc1)C(COS(=O)(=O)c1ccccc1)(COS(=O)(=O)c1ccccc1)Cc1ccc(cc1)OC
SPLASH splash10-00di-0900003000-57706b427f1d7b1d8ec7
Source of Spectrum AG-571-279-0
Wiley ID 1412899