(2''R,5''R,7''S)-2-[2'-(2''-Methyl-1'',6''-dioxaspiro[4.5]dec-7''-yl)ethylsulfonyl]-benzothiazole

SpectraBase Compound ID	CTcda6CCRcM
InChI	InChI=1S/C18H23NO4S2/c1-13-8-11-18(22-13)10-4-5-14(23-18)9-12-25(20,21)17-19-15-6-2-3-7-16(15)24-17/h2-3,6-7,13-14H,4-5,8-12H2,1H3/t13-,14+,18-/m1/s1
InChIKey	TUQMDDBBXLIDEG-QWQRMKEZSA-N Google Search
Mol Weight	381.51 g/mol
Molecular Formula	C18H23NO4S2
Exact Mass	381.106851 g/mol

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SpectraBase Spectrum ID	IH1favGfJhm
Name	(2''R,5''R,7''S)-2-[2'-(2''-Methyl-1'',6''-dioxaspiro[4.5]dec-7''-yl)ethylsulfonyl]-benzothiazole
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H23NO4S2
InChI	InChI=1S/C18H23NO4S2/c1-13-8-11-18(22-13)10-4-5-14(23-18)9-12-25(20,21)17-19-15-6-2-3-7-16(15)24-17/h2-3,6-7,13-14H,4-5,8-12H2,1H3/t13-,14+,18-/m1/s1
InChIKey	TUQMDDBBXLIDEG-QWQRMKEZSA-N
Molecular Weight	381.505 g/mol
SMILES	c1(S(CC[C@]2(O[C@]3(O[C@](C)(CC3)[H])CCC2)[H])(=O)=O)nc2ccccc2s1
SPLASH	splash10-000b-9410000000-7b0b1f8acd72ee816075
Source of Spectrum	F5-5-2580-4b
Synonyms	2-((2-((2R,5R,7S)-2-methyl-1,6-dioxaspiro[4.5]decan-7-yl)ethyl)sulfonyl)benzo[d]thiazole
Wiley ID	1733260