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(S)-4-METHYL-3-(4-METHYLPHENYL)-PENTANAL

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(S)-4-METHYL-3-(4-METHYLPHENYL)-PENTANAL
SpectraBase Compound ID KEYQ2EnoVCn
InChI InChI=1S/C13H18O/c1-10(2)13(8-9-14)12-6-4-11(3)5-7-12/h4-7,9-10,13H,8H2,1-3H3/t13-/m1/s1
InChIKey UJFJIGCHMRTKLU-CYBMUJFWSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FOn6tdjFbWc
Name (S)-4-METHYL-3-(4-METHYLPHENYL)-PENTANAL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-10(2)13(8-9-14)12-6-4-11(3)5-7-12/h4-7,9-10,13H,8H2,1-3H3/t13-/m1/s1
InChIKey UJFJIGCHMRTKLU-CYBMUJFWSA-N
Literature Reference Author K.TANAKA,G.C.FU
Literature Reference Citation J.ORG.CHEM.,66,8177(2001)
Literature Reference DOI 10.1021/jo010792v
Molecular Weight 190.285 g/mol
Solvent CDCl3
Source File Reference UWLU29053