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Dimethyl 5-(p-tolyl)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylate
SpectraBase Compound ID 1KVDOhHTP8Y
InChI InChI=1S/C17H20O5/c1-9-4-6-10(7-5-9)11-8-12-13(16(18)20-2)14(15(11)22-12)17(19)21-3/h4-7,11-15H,8H2,1-3H3/t11-,12-,13-,14-,15+/m0/s1
InChIKey YEANNMDBEALENM-YYFQZIEXSA-N
Mol Weight 304.34 g/mol
Molecular Formula C17H20O5
Exact Mass 304.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5ykoP92xXe
Name Dimethyl 5-(p-tolyl)-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O5
InChI InChI=1S/C17H20O5/c1-9-4-6-10(7-5-9)11-8-12-13(16(18)20-2)14(15(11)22-12)17(19)21-3/h4-7,11-15H,8H2,1-3H3/t11-,12-,13-,14-,15+/m0/s1
InChIKey YEANNMDBEALENM-YYFQZIEXSA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0004.203
Molecular Weight 304.342 g/mol
Quality 74
SMILES [C@]1([C@]2(O[C@@](C1)([C@@]([C@@]2(C(OC)=O)[H])(C(=O)OC)[H])[H])[H])(C1=CC=C(C=C1)C)[H]
SPLASH splash10-0f6x-0921000000-440e11aa2ce71b33fa5c
Source of Spectrum ARK-2003-19-6c (DOI: 10.3998/ark.5550190.0004.203)
Wiley ID 1899855