1-(4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl)ethyl 4-nitrobenzoate

SpectraBase Compound ID	EKcFWP128x3
InChI	InChI=1S/C20H27NO5S/c1-12-5-10-16-17(11-12)26-19(27-20(16,3)4)13(2)25-18(22)14-6-8-15(9-7-14)21(23)24/h6-9,12-13,16-17,19H,5,10-11H2,1-4H3
InChIKey	RUEOEDMYSMREHX-UHFFFAOYSA-N Google Search
Mol Weight	393.5 g/mol
Molecular Formula	C20H27NO5S
Exact Mass	393.160994 g/mol

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SpectraBase Spectrum ID	DpuPhUUmbyS
Name	1-(4,4,7-trimethyl-4a,5,6,7,8,8a-hexahydrobenzo[e][1,3]oxathiin-2-yl)ethyl 4-nitrobenzoate
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C20H27NO5S
InChI	InChI=1S/C20H27NO5S/c1-12-5-10-16-17(11-12)26-19(27-20(16,3)4)13(2)25-18(22)14-6-8-15(9-7-14)21(23)24/h6-9,12-13,16-17,19H,5,10-11H2,1-4H3
InChIKey	RUEOEDMYSMREHX-UHFFFAOYSA-N
Literature Reference Author	ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation	UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight	393.498 g/mol
Source File Reference	MHKO16926