(1S*,4S*,7S*)-7-(Benzyloxy)-5-cyano-3,3-trimethoxy-2-oxobicyclo[2.2.2]oct-5-en-2-one

SpectraBase Compound ID	GWRiLzSmmoC
InChI	InChI=1S/C18H19NO4/c1-21-18(22-2)15-9-16(14(17(18)20)8-13(15)10-19)23-11-12-6-4-3-5-7-12/h3-8,14-16H,9,11H2,1-2H3/t14-,15+,16+/m1/s1
InChIKey	HSVHXCSIHPGHBO-JYJNAYRXSA-N Google Search
Mol Weight	313.35 g/mol
Molecular Formula	C18H19NO4
Exact Mass	313.131408 g/mol

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SpectraBase Spectrum ID	B3nGU573GIi
Name	(1S,4S,7S*)-7-(Benzyloxy)-5-cyano-3,3-trimethoxy-2-oxobicyclo[2.2.2]oct-5-en-2-one
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H19NO4
InChI	InChI=1S/C18H19NO4/c1-21-18(22-2)15-9-16(14(17(18)20)8-13(15)10-19)23-11-12-6-4-3-5-7-12/h3-8,14-16H,9,11H2,1-2H3/t14-,15+,16+/m1/s1
InChIKey	HSVHXCSIHPGHBO-JYJNAYRXSA-N
Molecular Weight	313.353 g/mol
SMILES	C1(C([C@@]2([H])[C@](C[C@]1(C(=C2)C#N)[H])(OCc1ccccc1)[H])=O)(OC)OC
SPLASH	splash10-004i-6910000000-03dbef098f33ce251892
Source of Spectrum	F-57-305-3
Wiley ID	1549215