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(4R,5R,6R)-6-(3,3-dimethylbutyl)-5-methyl-4-phenyl-2-oxanone
SpectraBase Compound ID 7Zj4zXozAvg
InChI InChI=1S/C18H26O2/c1-13-15(14-8-6-5-7-9-14)12-17(19)20-16(13)10-11-18(2,3)4/h5-9,13,15-16H,10-12H2,1-4H3/t13-,15-,16-/m1/s1
InChIKey ZADDUPNGSYALEN-FVQBIDKESA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CHSdW2QNIeW
Name (4R,5R,6R)-6-(3,3-dimethylbutyl)-5-methyl-4-phenyl-2-oxanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-13-15(14-8-6-5-7-9-14)12-17(19)20-16(13)10-11-18(2,3)4/h5-9,13,15-16H,10-12H2,1-4H3/t13-,15-,16-/m1/s1
InChIKey ZADDUPNGSYALEN-FVQBIDKESA-N
Molecular Weight 274.404 g/mol
SMILES C1(O[C@@]([C@@]([C@@](C1)(c1ccccc1)[H])(C)[H])(CCC(C)(C)C)[H])=O
SPLASH splash10-014i-0910000000-bcfd2f16f38ef4d4394e
Source of Spectrum AJ-64-3003-18
Synonyms (4R,5R,6R)-6-(3,3-dimethylbutyl)-5-methyl-4-phenyl-oxan-2-one (4R,5R,6R)-6-(3,3-dimethylbutyl)-5-methyl-4-phenyl-tetrahydropyran-2-one
Wiley ID 1278532