Methyl [2-endo.gamma.-(p-bromobenzoxyl)butyryl)bicyclo[2.2.1]hept-5-ene-3-endo-thiocarboxylate

SpectraBase Compound ID	B0zXhtb6z7W
InChI	InChI=1S/C20H21BrO4S/c1-26-20(24)18-14-5-4-13(11-14)17(18)16(22)3-2-10-25-19(23)12-6-8-15(21)9-7-12/h4-9,13-14,17-18H,2-3,10-11H2,1H3/t13-,14+,17+,18-/m0/s1
InChIKey	IQKJIBMTWYWNJJ-JFTQMJAMSA-N Google Search
Mol Weight	437.35 g/mol
Molecular Formula	C20H21BrO4S
Exact Mass	436.034393 g/mol

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SpectraBase Spectrum ID	2b37QFp0oNx
Name	Methyl [2-endo.gamma.-(p-bromobenzoxyl)butyryl)bicyclo[2.2.1]hept-5-ene-3-endo-thiocarboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H21BrO4S
InChI	InChI=1S/C20H21BrO4S/c1-26-20(24)18-14-5-4-13(11-14)17(18)16(22)3-2-10-25-19(23)12-6-8-15(21)9-7-12/h4-9,13-14,17-18H,2-3,10-11H2,1H3/t13-,14+,17+,18-/m0/s1
InChIKey	IQKJIBMTWYWNJJ-JFTQMJAMSA-N
Molecular Weight	437.348 g/mol
SMILES	[C@@]12([C@@]([C@@](C(=O)CCCOC(c3ccc(cc3)Br)=O)([C@](C1)(C=C2)[H])[H])(C(=O)SC)[H])[H]
SPLASH	splash10-0019-0900000000-05e7620aa88721f2fc8e
Source of Spectrum	QA-43-183-5
Synonyms	Methyl[2-endo.gamma.-(p-Bromobenzoyloxyl)butyryl]bicyclo[2.2.1]hept-5-ene-3-endo-thiocarboxylate
Wiley ID	862231