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2H-Pyran-5-carboxylic acid, 4-(1-formyl-1-propenyl)-3,4-dihydro-2-hydroxy-, methyl ester, [2R-[2.alpha.,4.alpha.(E)]]-
SpectraBase Compound ID Bz1QVtPRU9Z
InChI InChI=1S/C11H14O5/c1-3-7(5-12)8-4-10(13)16-6-9(8)11(14)15-2/h3,5-6,8,10,13H,4H2,1-2H3/b7-3-/t8-,10+/m0/s1
InChIKey IHRHLUMPCZSAER-NPELTSOQSA-N
Mol Weight 226.23 g/mol
Molecular Formula C11H14O5
Exact Mass 226.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lw1MD2WC0i5
Name 2H-Pyran-5-carboxylic acid, 4-(1-formyl-1-propenyl)-3,4-dihydro-2-hydroxy-, methyl ester, [2R-[2.alpha.,4.alpha.(E)]]-
CAS Registry Number 61600-60-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O5
InChI InChI=1S/C11H14O5/c1-3-7(5-12)8-4-10(13)16-6-9(8)11(14)15-2/h3,5-6,8,10,13H,4H2,1-2H3/b7-3-/t8-,10+/m0/s1
InChIKey IHRHLUMPCZSAER-NPELTSOQSA-N
Molecular Weight 226.228 g/mol
SMILES O[C@@]1(OC=C([C@](\C(=C/C)C=O)(C1)[H])C(=O)OC)[H]
SPLASH splash10-03fu-0950000000-68ca2e9bff0bc31bb271
Source of Spectrum K-109-3645-0
Synonyms Methyl (2R,4S)-4-[(1E)-1-formyl-1-propenyl]-2-hydroxy-3,4-dihydro-2H-pyran-5-carboxylate Methyl ester of 4.alpha.-(1-formyl-(E)-1-propenyl)-2.alpha.,.beta.-hydroxy-3,4-dihydro-2H-pyran-5-carboxylic acid
Wiley ID 1227033