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(1R,4S,5S)-2,2,4-trimethyl-5-(1-methylethenyl)-3-bicyclo[2.2.2]octanone
SpectraBase Compound ID 810y3ziLcL8
InChI InChI=1S/C14H22O/c1-9(2)11-8-10-6-7-14(11,5)12(15)13(10,3)4/h10-11H,1,6-8H2,2-5H3/t10-,11+,14+/m1/s1
InChIKey RAUQZZGALHMRDQ-SUNKGSAMSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wdY0cBquyO
Name (1R,4S,5S)-2,2,4-trimethyl-5-(1-methylethenyl)-3-bicyclo[2.2.2]octanone
Alternate Name(s) (1R,4S,5S)-2,2,4-trimethyl-5-prop-1-en-2-yl-bicyclo[2.2.2]octan-3-one (1R,4S,5S)-5-isopropenyl-2,2,4-trimethyl-bicyclo[2.2.2]octan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-9(2)11-8-10-6-7-14(11,5)12(15)13(10,3)4/h10-11H,1,6-8H2,2-5H3/t10-,11+,14+/m1/s1
InChIKey RAUQZZGALHMRDQ-SUNKGSAMSA-N
Molecular Weight 206.329 g/mol
SMILES [C@]12(C(C(C)(C)[C@@](CC2)([H])C[C@]1(C(=C)C)[H])=O)C
SPLASH splash10-0btd-5910000000-f078282a3d79ff74b51b
Source of Spectrum KD-16-3995-7
Wiley ID 1638052