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[(2S,4R)-4-methyl-2-(p-tolyl)tetrahydropyran-4-yl] butanoate
SpectraBase Compound ID F5qAU4Oo72C
InChI InChI=1S/C17H24O3/c1-4-5-16(18)20-17(3)10-11-19-15(12-17)14-8-6-13(2)7-9-14/h6-9,15H,4-5,10-12H2,1-3H3/t15-,17+/m0/s1
InChIKey IXIYFABVXSNWLN-DOTOQJQBSA-N
Mol Weight 276.38 g/mol
Molecular Formula C17H24O3
Exact Mass 276.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ky8jylleDjS
Name [(2S,4R)-4-methyl-2-(p-tolyl)tetrahydropyran-4-yl] butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O3
InChI InChI=1S/C17H24O3/c1-4-5-16(18)20-17(3)10-11-19-15(12-17)14-8-6-13(2)7-9-14/h6-9,15H,4-5,10-12H2,1-3H3/t15-,17+/m0/s1
InChIKey IXIYFABVXSNWLN-DOTOQJQBSA-N
Ionization Type EI
Molecular Weight 276.376 g/mol
SMILES C1[C@](C[C@](OC1)(c1ccc(cc1)C)[H])(OC(CCC)=O)C
SPLASH splash10-00di-2900000000-2e174cca6109aa0df449
Source of Spectrum EP3464258A1
Wiley ID 1872808