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(2S,3S)-3-hydroxy-4-methoxy-2-phenethyl-2,3-dihydropyran-6-one
SpectraBase Compound ID IItBab1jFPB
InChI InChI=1S/C14H16O4/c1-17-12-9-13(15)18-11(14(12)16)8-7-10-5-3-2-4-6-10/h2-6,9,11,14,16H,7-8H2,1H3/t11-,14-/m0/s1
InChIKey VJCNEDVMYQCMBK-FZMZJTMJSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCdAcnmbNSr
Name (2S,3S)-3-hydroxy-4-methoxy-2-phenethyl-2,3-dihydropyran-6-one
Alternate Name(s) (2S,3S)-3-hydroxy-4-methoxy-2-(2-phenylethyl)-2,3-dihydropyran-6-one
CAS Registry Number 56083-47-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-17-12-9-13(15)18-11(14(12)16)8-7-10-5-3-2-4-6-10/h2-6,9,11,14,16H,7-8H2,1H3/t11-,14-/m0/s1
InChIKey VJCNEDVMYQCMBK-FZMZJTMJSA-N
Molecular Weight 248.278 g/mol
SMILES O[C@@]1(C(=CC(O[C@]1(CCc1ccccc1)[H])=O)OC)[H]
SPLASH splash10-0btl-9400000000-05322321c8a083dc26fa
Source of Spectrum K-106-575-9
Wiley ID 1251036