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BICYCLO[3.1.1]HEPTAN-3-ONE, 6,6-DIMETHYL-2-(2METHYLPROPYL)-, (DIASTEREOMERES)
SpectraBase Compound ID 5L82NYOZTLV
InChI InChI=1S/C13H22O/c1-8(2)5-10-11-6-9(7-12(10)14)13(11,3)4/h8-11H,5-7H2,1-4H3/t9-,10?,11+/m1/s1
InChIKey BLQUUSSRJOLJLD-FBKFWFMHSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IoYzowCa2D3
Name BICYCLO[3.1.1]HEPTAN-3-ONE, 6,6-DIMETHYL-2-(2-METHYLPROPYL)-, (DIASTEREOMERES)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-8(2)5-10-11-6-9(7-12(10)14)13(11,3)4/h8-11H,5-7H2,1-4H3/t9-,10?,11+/m1/s1
InChIKey BLQUUSSRJOLJLD-FBKFWFMHSA-N
Molecular Weight 194.1665
SMILES C1(CC(C)C)C(=O)C[C@]2(C[C@@]1(C2(C)C)[H])[H]
SPLASH splash10-014j-9100000000-998ecd35b38757f29eb4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany