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(+)-(1R.2S)-2-Benzyl 3-Methyl Bicyclo[2.2.2]octa-2,5-diene-2,3-dicarboxylate
SpectraBase Compound ID HG6INaQPhho
InChI InChI=1S/C18H18O4/c1-21-17(19)15-13-7-9-14(10-8-13)16(15)18(20)22-11-12-5-3-2-4-6-12/h2-7,9,13-14H,8,10-11H2,1H3/t13?,14-/m0/s1
InChIKey ZHVPICPTRNRHLD-KZUDCZAMSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fy24JERR90J
Name (+)-(1R.2S)-2-Benzyl 3-Methyl Bicyclo[2.2.2]octa-2,5-diene-2,3-dicarboxylate
Alternate Name(s) (+)-(1R)-2-Benzyl 3-Methyl Bicyclo[2.2.2]octa-2,5-diene-2,3-dicarboxylate 2-Benzyl 3-methyl (1R)-bicyclo[2.2.2]octa-2,5-diene-2,3-dicarboxylate
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Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-21-17(19)15-13-7-9-14(10-8-13)16(15)18(20)22-11-12-5-3-2-4-6-12/h2-7,9,13-14H,8,10-11H2,1H3/t13?,14-/m0/s1
InChIKey ZHVPICPTRNRHLD-KZUDCZAMSA-N
Molecular Weight 298.338 g/mol
SMILES C1(=C(C(=O)OC)C2C=C[C@]1(CC2)[H])C(OCc1ccccc1)=O
SPLASH splash10-0006-6900000000-4a03d7dde5643b7b390e
Source of Spectrum J-59-1507-5
Wiley ID 1301128