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2H-Pyran-2-acetic acid, tetrahydro-.alpha.,5-dimethyl-6-(1-oxopropoxy)-, methyl ester, [2R-[2.alpha.(R*),5.beta.,6.beta.]]-
SpectraBase Compound ID Cd782RHFlFF
InChI InChI=1S/C13H22O5/c1-5-11(14)18-13-8(2)6-7-10(17-13)9(3)12(15)16-4/h8-10,13H,5-7H2,1-4H3/t8-,9?,10+,13-/m0/s1
InChIKey BUGKZCFBOHSMIB-MWHZGQMISA-N
Mol Weight 258.31 g/mol
Molecular Formula C13H22O5
Exact Mass 258.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIr0zBMITGg
Name 2H-Pyran-2-acetic acid, tetrahydro-.alpha.,5-dimethyl-6-(1-oxopropoxy)-, methyl ester, [2R-[2.alpha.(R*),5.beta.,6.beta.]]-
CAS Registry Number 76566-86-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O5
InChI InChI=1S/C13H22O5/c1-5-11(14)18-13-8(2)6-7-10(17-13)9(3)12(15)16-4/h8-10,13H,5-7H2,1-4H3/t8-,9?,10+,13-/m0/s1
InChIKey BUGKZCFBOHSMIB-MWHZGQMISA-N
Molecular Weight 258.314 g/mol
SMILES [C@@]1(O[C@](CC[C@@]1(C)[H])(C(C(=O)OC)C)[H])(OC(=O)CC)[H]
SPLASH splash10-0udr-0900000000-99803dab8ad4522b0026
Source of Spectrum J-50-1447-5
Synonyms Methyl 2-[(2R,5S,6S)-5-methyl-6-(propionyloxy)tetrahydro-2H-pyran-2-yl]propanoate
Wiley ID 1261564