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(1R*,2R*,5S*,7R*)-7-Isopropyl-2-methyl-2-(1-oxoethyl)-5-phenyl-8-oxabicyclo[3.2.1]octan-3-one
SpectraBase Compound ID INdyP4APYYN
InChI InChI=1S/C19H24O3/c1-12(2)15-10-19(14-8-6-5-7-9-14)11-16(21)18(4,13(3)20)17(15)22-19/h5-9,12,15,17H,10-11H2,1-4H3/t15-,17-,18-,19+/m1/s1
InChIKey IHHHKKNIMRCXBD-OWYHZJEWSA-N
Mol Weight 300.4 g/mol
Molecular Formula C19H24O3
Exact Mass 300.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1tNKeN7WW8
Name (1R*,2R*,5S*,7R*)-7-Isopropyl-2-methyl-2-(1-oxoethyl)-5-phenyl-8-oxabicyclo[3.2.1]octan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O3
InChI InChI=1S/C19H24O3/c1-12(2)15-10-19(14-8-6-5-7-9-14)11-16(21)18(4,13(3)20)17(15)22-19/h5-9,12,15,17H,10-11H2,1-4H3/t15-,17-,18-,19+/m1/s1
InChIKey IHHHKKNIMRCXBD-OWYHZJEWSA-N
Molecular Weight 300.398 g/mol
SMILES [C@]1([C@@]2(O[C@@](CC1=O)(c1ccccc1)C[C@@]2(C(C)C)[H])[H])(C(=O)C)C
SPLASH splash10-0ap0-2910000000-4445e4abc5c7f92b0a9f
Source of Spectrum C-115-842-17
Synonyms (1S,4R,5R,6R)-4-acetyl-6-isopropyl-4-methyl-1-phenyl-8-oxabicyclo[3.2.1]octan-3-one
Wiley ID 1303255