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(2R,3S,4aS,8aR)-2-[(Methoxycarbonyl)methyl]octahydropyrano[3,2-b]pyran-3-yl Benzoate

View entire compound with spectra: 1 MS (GC)

(2R,3S,4aS,8aR)-2-[(Methoxycarbonyl)methyl]octahydropyrano[3,2-b]pyran-3-yl Benzoate
SpectraBase Compound ID BbKe58UU3RR
InChI InChI=1S/C18H22O6/c1-21-17(19)11-16-15(10-14-13(23-16)8-5-9-22-14)24-18(20)12-6-3-2-4-7-12/h2-4,6-7,13-16H,5,8-11H2,1H3/t13-,14+,15+,16-/m1/s1
InChIKey YHMJSZRBMJKPKY-FXUDXRNXSA-N
Mol Weight 334.37 g/mol
Molecular Formula C18H22O6
Exact Mass 334.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGpQD9iiOd0
Name (2R,3S,4aS,8aR)-2-[(Methoxycarbonyl)methyl]octahydropyrano[3,2-b]pyran-3-yl Benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O6
InChI InChI=1S/C18H22O6/c1-21-17(19)11-16-15(10-14-13(23-16)8-5-9-22-14)24-18(20)12-6-3-2-4-7-12/h2-4,6-7,13-16H,5,8-11H2,1H3/t13-,14+,15+,16-/m1/s1
InChIKey YHMJSZRBMJKPKY-FXUDXRNXSA-N
Molecular Weight 334.368 g/mol
SMILES [C@]1(O[C@]2([C@](C[C@@]1(OC(=O)c1ccccc1)[H])(OCCC2)[H])[H])(CC(=O)OC)[H]
SPLASH splash10-0bxr-9970000000-aeeb0099d499e5fd2b2d
Source of Spectrum J-62-4582-95
Synonyms (2R,3S,4aS,8aR)-2-(2-methoxy-2-oxoethyl)-octahydropyrano[3,2-b]pyran-3-yl benzoate benzoic acid[(2R,3S,4aS,8aR)-2-(2-keto-2-methoxy-ethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl]ester benzoic acid[(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxoethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl]ester [(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxidanylidene-ethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl]benzoate [(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxo-ethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl]benzoate benzoic acid [(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxoethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl] ester [(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxoethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl] benzoate [(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxo-ethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl] benzoate [(2R,3S,4aS,8aR)-2-(2-methoxy-2-oxidanylidene-ethyl)-2,3,4,4a,6,7,8,8a-octahydropyrano[3,2-b]pyran-3-yl] benzoate
Wiley ID 1330894