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KWCZGIDDMXESID-UHFFFAOYSA-N

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KWCZGIDDMXESID-UHFFFAOYSA-N
SpectraBase Compound ID 8rl2hqR7HRf
InChI InChI=1S/C13H14O3/c1-7-4-5-8(2)11-9(7)6-10(12(11)14)13(15)16-3/h4-5,10H,6H2,1-3H3
InChIKey KWCZGIDDMXESID-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbRYrhrnVC3
Name 2-CARBOXYMETHYL-4,7-DIMETHYL-INDAN-1-ONE
Compound Number 15 C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-7-4-5-8(2)11-9(7)6-10(12(11)14)13(15)16-3/h4-5,10H,6H2,1-3H3
InChIKey KWCZGIDDMXESID-UHFFFAOYSA-N
Literature Reference Author H.K.NEUDECK
Literature Reference Citation MH.CHEM.,127,185(1996)
Literature Reference DOI 10.1007/BF00807400
Molecular Weight 218.252 g/mol
Solvent CDCl3
Source File Reference UWMZ480