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Propanedioic acid, [2-[(acetyloxy)methyl]-6-ethoxy-3,6-dihydro-2H-pyran-3-yl]-, diethyl ester, [2S-(2.alpha.,3.beta.,6.beta.)]-
SpectraBase Compound ID 4TS8SIlCZOR
InChI InChI=1S/C17H26O8/c1-5-21-14-9-8-12(13(25-14)10-24-11(4)18)15(16(19)22-6-2)17(20)23-7-3/h8-9,12-15H,5-7,10H2,1-4H3/t12-,13+,14-/m0/s1
InChIKey BNAUPBHGCVPDEE-MJBXVCDLSA-N
Mol Weight 358.39 g/mol
Molecular Formula C17H26O8
Exact Mass 358.162768 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HvFovD4VYCc
Name Propanedioic acid, [2-[(acetyloxy)methyl]-6-ethoxy-3,6-dihydro-2H-pyran-3-yl]-, diethyl ester, [2S-(2.alpha.,3.beta.,6.beta.)]-
CAS Registry Number 73189-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O8
InChI InChI=1S/C17H26O8/c1-5-21-14-9-8-12(13(25-14)10-24-11(4)18)15(16(19)22-6-2)17(20)23-7-3/h8-9,12-15H,5-7,10H2,1-4H3/t12-,13+,14-/m0/s1
InChIKey BNAUPBHGCVPDEE-MJBXVCDLSA-N
Molecular Weight 358.387 g/mol
SMILES C([C@]1(C=C[C@](O[C@@]1(COC(=O)C)[H])(OCC)[H])[H])(C(=O)OCC)C(=O)OCC
SPLASH splash10-001i-0950000000-2abcb7c0fc22c23cab66
Source of Spectrum I-59-893-1
Synonyms Diethyl 2-{(2S,3R,6S)-2-[(acetyloxy)methyl]-6-ethoxy-3,6-dihydro-2H-pyran-3-yl}malonate Ethyl 6-O-acetyl-2,3,4-trideoxy-4-[bis(ethoxycarbonyl)-methyl]-.alpha.-D-erythro-hex-2-enopyranoside
Wiley ID 1346877