[3-(p-tolylsulfonyloxymethyl)-1-adamantyl]methyl 4-methylbenzenesulfonate

SpectraBase Compound ID	EfV1xL10qlM
InChI	InChI=1S/C26H32O6S2/c1-19-3-7-23(8-4-19)33(27,28)31-17-25-12-21-11-22(13-25)15-26(14-21,16-25)18-32-34(29,30)24-9-5-20(2)6-10-24/h3-10,21-22H,11-18H2,1-2H3/t21-,22?,25+,26-
InChIKey	VHYGSWGBJYAMHK-WYFYVUJLSA-N Google Search
Mol Weight	504.7 g/mol
Molecular Formula	C26H32O6S2
Exact Mass	504.164031 g/mol

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SpectraBase Spectrum ID	2QEF6QwQ7M
Name	[3-(p-tolylsulfonyloxymethyl)-1-adamantyl]methyl 4-methylbenzenesulfonate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H32O6S2
InChI	InChI=1S/C26H32O6S2/c1-19-3-7-23(8-4-19)33(27,28)31-17-25-12-21-11-22(13-25)15-26(14-21,16-25)18-32-34(29,30)24-9-5-20(2)6-10-24/h3-10,21-22H,11-18H2,1-2H3/t21-,22?,25+,26-
InChIKey	VHYGSWGBJYAMHK-WYFYVUJLSA-N
Molecular Weight	504.656 g/mol
SMILES	c1(S(OC[C@]23C[C@@]4(COS(c5ccc(cc5)C)(=O)=O)CC(C3)C[C@@](C2)(C4)[H])(=O)=O)ccc(cc1)C
SPLASH	splash10-0005-5902000000-7b3ef50f9da0959c198d
Source of Spectrum	K-127-1152-2
Synonyms	4-Methylbenzenesulfonic acid [3-[(4-methylphenyl)sulfonyloxymethyl]-1-adamantyl]methyl ester [3-[(4-methylphenyl)sulfonyloxymethyl]-1-adamantyl]methyl 4-methylbenzenesulfonate
Wiley ID	1399498