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(2S,3S,6S)-3,6-Dimethyl-2-phenyl-tetrahydro-pyran-4-one

View entire compound with spectra: 1 MS (GC)

(2S,3S,6S)-3,6-Dimethyl-2-phenyl-tetrahydro-pyran-4-one
SpectraBase Compound ID 10rQwfnNZFj
InChI InChI=1S/C13H16O2/c1-9-8-12(14)10(2)13(15-9)11-6-4-3-5-7-11/h3-7,9-10,13H,8H2,1-2H3/t9-,10+,13-/m0/s1
InChIKey CBKSURMVGQBPAR-CWSCBRNRSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MsNCTGvI7D
Name (2S,3S,6S)-3,6-Dimethyl-2-phenyl-tetrahydro-pyran-4-one
Alternate Name(s) Tetrahydro-3,6-dimethyl-2-phenylpyran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-9-8-12(14)10(2)13(15-9)11-6-4-3-5-7-11/h3-7,9-10,13H,8H2,1-2H3/t9-,10+,13-/m0/s1
InChIKey CBKSURMVGQBPAR-CWSCBRNRSA-N
Molecular Weight 204.269 g/mol
SMILES [C@@]1([C@@](C(=O)C[C@@](O1)(C)[H])(C)[H])(c1ccccc1)[H]
SPLASH splash10-11or-0960000000-56c533ff007b0012a318
Source of Spectrum F-68-3919-4
Wiley ID 1708594