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ETHYL-6-O-ACETYL-2,3,4-TRIDEOXY-2-[BIS-(METHOXYCARBONYL)-METHYL]-ALPHA-D-THREO-HEX-3-ENOPYRANOSIDE
SpectraBase Compound ID 5cmvqTgN9TS
InChI InChI=1S/C15H22O8/c1-5-21-15-11(12(13(17)19-3)14(18)20-4)7-6-10(23-15)8-22-9(2)16/h6-7,10-12,15H,5,8H2,1-4H3/t10-,11+,15-/m0/s1
InChIKey HDFJAKXXKFMMIP-RWSFTLGLSA-N
Mol Weight 330.33 g/mol
Molecular Formula C15H22O8
Exact Mass 330.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsN5ZW0G0NN
Name Propanedioic acid, [6-[(acetyloxy)methyl]-2-ethoxy-3,6-dihydro-2H-pyran-3-yl]-, dimethyl ester, [2S-(2.alpha.,3.beta.,6.beta.)]-
CAS Registry Number 78081-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O8
InChI InChI=1S/C15H22O8/c1-5-21-15-11(12(13(17)19-3)14(18)20-4)7-6-10(23-15)8-22-9(2)16/h6-7,10-12,15H,5,8H2,1-4H3/t10-,11+,15-/m0/s1
InChIKey HDFJAKXXKFMMIP-RWSFTLGLSA-N
Molecular Weight 330.333 g/mol
SMILES C([C@@]1([C@](O[C@@](C=C1)(COC(=O)C)[H])(OCC)[H])[H])(C(=O)OC)C(=O)OC
SPLASH splash10-014i-0930000000-29e869ced01f4b0f067d
Source of Spectrum I-59-893-1
Synonyms Dimethyl 2-{(2S,3R,6S)-6-[(acetyloxy)methyl]-2-ethoxy-3,6-dihydro-2H-pyran-3-yl}malonate Ethyl 6-O-acetyl-2,3,4-trideoxy-2-[bis(methoxycarbonyl)-methyl]-.alpha.-D-threo-hex-3-enopyranoside Ethyl 6-O-acetyl-2,3,4-trideoxy-4-[bis(methoxycarbonyl)-methyl]-.alpha.-D-erythro-hex-2-enopyranoside
Wiley ID 1327552