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Dimethyl (3aS,7aR)-7-hydroxy-2,5-dimethyl-3a,4,5,7a-tetrahydro-1-benzofuran-3,6-dicarboxylate
SpectraBase Compound ID 7KZZxpCnxMr
InChI InChI=1S/C14H18O6/c1-6-5-8-10(14(17)19-4)7(2)20-12(8)11(15)9(6)13(16)18-3/h6,8,12,15H,5H2,1-4H3/t6?,8-,12+/m0/s1
InChIKey ACCCXKJYFXCKNE-DVOYJDGVSA-N
Mol Weight 282.29 g/mol
Molecular Formula C14H18O6
Exact Mass 282.110338 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGhSPZxt8We
Name Dimethyl (3aS,7aR)-7-hydroxy-2,5-dimethyl-3a,4,5,7a-tetrahydro-1-benzofuran-3,6-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O6
InChI InChI=1S/C14H18O6/c1-6-5-8-10(14(17)19-4)7(2)20-12(8)11(15)9(6)13(16)18-3/h6,8,12,15H,5H2,1-4H3/t6?,8-,12+/m0/s1
InChIKey ACCCXKJYFXCKNE-DVOYJDGVSA-N
Molecular Weight 282.292 g/mol
SMILES OC=1[C@]2([C@](C(=C(O2)C)C(=O)OC)(CC(C1C(=O)OC)C)[H])[H]
SPLASH splash10-0udr-0920000000-955c660dec15a8e08739
Source of Spectrum F-53-2250-9
Synonyms Dimethyl (3aS,7aR)-7-hydroxy-2,5-dimethyl-3a,4,5,7a-tetrahydrobenzofuran-3,6-dicarboxylate Dimethyl (3aS,7aR)-2,5-dimethyl-7-oxidanyl-3a,4,5,7a-tetrahydro-1-benzofuran-3,6-dicarboxylate
Wiley ID 800596