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4-METHYLBENZYL-HYDROGEN-SUCCINATE

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4-METHYLBENZYL-HYDROGEN-SUCCINATE
SpectraBase Compound ID LG4uxH03p1a
InChI InChI=1S/C12H14O4/c1-9-2-4-10(5-3-9)8-16-12(15)7-6-11(13)14/h2-5H,6-8H2,1H3,(H,13,14)
InChIKey BSBHNNRNSYPBQF-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5fXSCjYCdGM
Name 4-METHYLBENZYL-HYDROGEN-SUCCINATE
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-9-2-4-10(5-3-9)8-16-12(15)7-6-11(13)14/h2-5H,6-8H2,1H3,(H,13,14)
InChIKey BSBHNNRNSYPBQF-UHFFFAOYSA-N
Literature Reference Author M.IQBAL,I.B.BALOCH,M.K.BALOCH
Literature Reference Citation CHEM.J.,2,13(2012)
Molecular Weight 222.241 g/mol
Solvent CDCl3
Source File Reference UWLU76834