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(1'R*,5'S*)-4-(5'-tert-Butyl-2',2'-dimethylcyclopentyl)butan-2-one
SpectraBase Compound ID 7inEe7teYN5
InChI InChI=1S/C15H28O/c1-11(16)7-8-13-12(14(2,3)4)9-10-15(13,5)6/h12-13H,7-10H2,1-6H3/t12-,13+/m0/s1
InChIKey MCULEFPHEDMLFM-QWHCGFSZSA-N
Mol Weight 224.39 g/mol
Molecular Formula C15H28O
Exact Mass 224.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zPa3vrEKAI
Name (1'R*,5'S*)-4-(5'-tert-Butyl-2',2'-dimethylcyclopentyl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O
InChI InChI=1S/C15H28O/c1-11(16)7-8-13-12(14(2,3)4)9-10-15(13,5)6/h12-13H,7-10H2,1-6H3/t12-,13+/m0/s1
InChIKey MCULEFPHEDMLFM-QWHCGFSZSA-N
Molecular Weight 224.388 g/mol
SMILES [C@@]1([C@](CCC1(C)C)(C(C)(C)C)[H])(CCC(=O)C)[H]
SPLASH splash10-0a4m-9200000000-b2513a2423a82a994348
Source of Spectrum U1-2014-561-24
Synonyms 4-((1R,5S)-5-(tert-butyl)-2,2-dimethylcyclopentyl)butan-2-one
Wiley ID 1740443