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2-[1-(4-methylphenoxy)cyclopropyl]malonic acid diethyl ester
SpectraBase Compound ID LLzDp3FNphj
InChI InChI=1S/C17H22O5/c1-4-20-15(18)14(16(19)21-5-2)17(10-11-17)22-13-8-6-12(3)7-9-13/h6-9,14H,4-5,10-11H2,1-3H3
InChIKey AFKDVFJMVJQPJA-UHFFFAOYSA-N
Mol Weight 306.36 g/mol
Molecular Formula C17H22O5
Exact Mass 306.146724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K11yHlimVlk
Name 2-[1-(4-methylphenoxy)cyclopropyl]malonic acid diethyl ester
Alternate Name(s) 2-[1-(4-methylphenoxy)cyclopropyl]propanedioic acid diethyl ester Diethyl 2-[1-(4-methylphenoxy)cyclopropyl]propanedioate
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Formula C17H22O5
InChI InChI=1S/C17H22O5/c1-4-20-15(18)14(16(19)21-5-2)17(10-11-17)22-13-8-6-12(3)7-9-13/h6-9,14H,4-5,10-11H2,1-3H3
InChIKey AFKDVFJMVJQPJA-UHFFFAOYSA-N
Molecular Weight 306.358 g/mol
SMILES C(C(C(=O)OCC)C1(CC1)Oc1ccc(cc1)C)(=O)OCC
SPLASH splash10-0a4r-1900000000-de8d6e061f47d70b7bc7
Source of Spectrum K1-2004-3998-10
Wiley ID 1561530