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trans-(2S,3R)-3-Methyl-2-phenyloctan-4-one
SpectraBase Compound ID L0tFKCrStj3
InChI InChI=1S/C15H22O/c1-4-5-11-15(16)13(3)12(2)14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3/t12-,13+/m0/s1
InChIKey BCOJLCIPJMABRB-QWHCGFSZSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HziXLhUltuL
Name trans-(2S,3R)-3-Methyl-2-phenyloctan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O
InChI InChI=1S/C15H22O/c1-4-5-11-15(16)13(3)12(2)14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3/t12-,13+/m0/s1
InChIKey BCOJLCIPJMABRB-QWHCGFSZSA-N
Molecular Weight 218.340 g/mol
SMILES [C@]([C@@](c1ccccc1)(C)[H])(C(=O)CCCC)(C)[H]
SPLASH splash10-0a4i-9700000000-0d71d561427ab36dc54b
Source of Spectrum QE-6-2761-33
Synonyms (2S,3R)-3-methyl-2-phenyl-4-octanone
Wiley ID 845023