(1R,4S,5R)-5-acetyl-2,2,4-trimethyl-3-bicyclo[2.2.2]octanone

SpectraBase Compound ID	6kIYjkbbawR
InChI	InChI=1S/C13H20O2/c1-8(14)10-7-9-5-6-13(10,4)11(15)12(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,13+/m1/s1
InChIKey	SSBUTIOMQWXGHP-NRUUGDAUSA-N Google Search
Mol Weight	208.3 g/mol
Molecular Formula	C13H20O2
Exact Mass	208.14633 g/mol

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SpectraBase Spectrum ID	5nMWdgf0PqW
Name	(1R,4S,5R)-5-acetyl-2,2,4-trimethyl-3-bicyclo[2.2.2]octanone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H20O2
InChI	InChI=1S/C13H20O2/c1-8(14)10-7-9-5-6-13(10,4)11(15)12(9,2)3/h9-10H,5-7H2,1-4H3/t9-,10+,13+/m1/s1
InChIKey	SSBUTIOMQWXGHP-NRUUGDAUSA-N
Molecular Weight	208.301 g/mol
SMILES	[C@]12(C(C(C)(C)[C@@](CC2)([H])C[C@]1(C(=O)C)[H])=O)C
SPLASH	splash10-0abm-3900000000-ff83a529e0f32f4c0989
Source of Spectrum	KD-16-3995-14
Synonyms	(1R,4S,5R)-5-acetyl-2,2,4-trimethyl-bicyclo[2.2.2]octan-3-one (1R,4S,5R)-5-ethanoyl-2,2,4-trimethyl-bicyclo[2.2.2]octan-3-one
Wiley ID	1638051