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Methyl (2SR,4RS)-4-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-3,4-dihydro-2-phenoxy-2H-pyran-5-carboxylate
SpectraBase Compound ID kUKtQRb1hm
InChI InChI=1S/C20H26O6/c1-20(2)12-24-17(25-13-20)9-14-10-18(23-11-16(14)19(21)22-3)26-15-7-5-4-6-8-15/h4-8,11,14,17-18H,9-10,12-13H2,1-3H3
InChIKey HRETXLGUFIHXBK-UHFFFAOYSA-N
Mol Weight 362.42 g/mol
Molecular Formula C20H26O6
Exact Mass 362.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77kM9Zr3FV4
Name Methyl (2SR,4RS)-4-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-3,4-dihydro-2-phenoxy-2H-pyran-5-carboxylate
CAS Registry Number 117960-97-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H26O6
InChI InChI=1S/C20H26O6/c1-20(2)12-24-17(25-13-20)9-14-10-18(23-11-16(14)19(21)22-3)26-15-7-5-4-6-8-15/h4-8,11,14,17-18H,9-10,12-13H2,1-3H3
InChIKey HRETXLGUFIHXBK-UHFFFAOYSA-N
Molecular Weight 362.422 g/mol
SMILES C1(=COC(CC1CC1OCC(CO1)(C)C)Oc1ccccc1)C(=O)OC
SPLASH splash10-000i-0900000000-58bc7dcd65e304a3a9ce
Source of Spectrum K-122-649-37
Synonyms Methyl 4-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-2-phenoxy-3,4-dihydro-2H-pyran-5-carboxylate
Wiley ID 1349609