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(R)-2-Benzyl 1-Methyl 5-Methyl-2,4-cyclohexadiene-1,2-dicarboxylate
SpectraBase Compound ID DUuHpcxLuLk
InChI InChI=1S/C17H18O4/c1-12-8-9-14(17(2,10-12)16(19)20)15(18)21-11-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H,19,20)/t17-/m1/s1
InChIKey YLFPEOVFAVGGFG-QGZVFWFLSA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3zTBj2NCSYs
Name (R)-2-Benzyl 1-Methyl 5-Methyl-2,4-cyclohexadiene-1,2-dicarboxylate
Alternate Name(s) (1R)-2-[(benzyloxy)carbonyl]-1,5-dimethyl-2,4-cyclohexadiene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-12-8-9-14(17(2,10-12)16(19)20)15(18)21-11-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H,19,20)/t17-/m1/s1
InChIKey YLFPEOVFAVGGFG-QGZVFWFLSA-N
Molecular Weight 286.327 g/mol
SMILES OC([C@]1(C(=CC=C(C)C1)C(OCc1ccccc1)=O)C)=O
SPLASH splash10-0006-9410000000-bf4809baad84645219ca
Source of Spectrum J-59-1507-7
Wiley ID 1290028