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3,7-DIMETHYLINDAN-5-CARBOXYLIC-ACID
SpectraBase Compound ID ZLQ8otrigK
InChI InChI=1S/C12H14O2/c1-7-3-4-10-8(2)5-9(12(13)14)6-11(7)10/h5-7H,3-4H2,1-2H3,(H,13,14)
InChIKey YGZDWJVKOQPZDX-UHFFFAOYSA-N
Mol Weight 190.24 g/mol
Molecular Formula C12H14O2
Exact Mass 190.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDJv7N8BSWl
Name 3,7-DIMETHYLINDAN-5-CARBOXYLIC-ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O2
InChI InChI=1S/C12H14O2/c1-7-3-4-10-8(2)5-9(12(13)14)6-11(7)10/h5-7H,3-4H2,1-2H3,(H,13,14)
InChIKey YGZDWJVKOQPZDX-UHFFFAOYSA-N
Literature Reference Author W.J.SYU,C.C.SHEN,M.J.DON,J.C.OU,G.H.LEE,C.M.SUN
Literature Reference Citation J.NAT.PROD.,61,1531(1998)
Literature Reference DOI 10.1021/np980269k
Molecular Weight 190.242 g/mol
Solvent ACETONE-D6
Source File Reference UWGE1047