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Methyl (2RS,4SR)/(2SR,4SR)-2-(Benzyloxy)-4-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-3,4-dihydro-2H-pyran-5-carboxylate
SpectraBase Compound ID FN876juTxW5
InChI InChI=1S/C21H28O6/c1-21(2)13-26-19(27-14-21)10-16-9-18(25-12-17(16)20(22)23-3)24-11-15-7-5-4-6-8-15/h4-8,12,16,18-19H,9-11,13-14H2,1-3H3
InChIKey IELNKUSPSIYPGI-UHFFFAOYSA-N
Mol Weight 376.45 g/mol
Molecular Formula C21H28O6
Exact Mass 376.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AVeJVP1FGC1
Name Methyl (2RS,4SR)/(2SR,4SR)-2-(Benzyloxy)-4-[(5,5-dimethyl-1,3-dioxan-2-yl)methyl]-3,4-dihydro-2H-pyran-5-carboxylate
Alternate Name(s) Methyl 2-(benzyloxy)-4-((5,5-dimethyl-1,3-dioxan-2-yl)methyl)-3,4-dihydro-2H-pyran-5-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O6
InChI InChI=1S/C21H28O6/c1-21(2)13-26-19(27-14-21)10-16-9-18(25-12-17(16)20(22)23-3)24-11-15-7-5-4-6-8-15/h4-8,12,16,18-19H,9-11,13-14H2,1-3H3
InChIKey IELNKUSPSIYPGI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19891220410
Molecular Weight 376.449 g/mol
SMILES C1C(OC=C(C1CC1OCC(CO1)(C)C)C(=O)OC)OCc1ccccc1
SPLASH splash10-014r-2900000000-ccd0c6a13dd6cf9952b2
Source of Spectrum K-122-648-(33a,b)
Wiley ID 1793010