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4,4-Dimethylpenta-1,2-dienylbenzene

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4,4-Dimethylpenta-1,2-dienylbenzene
SpectraBase Compound ID Hn2PN3ccIFf
InChI InChI=1S/C13H16/c1-13(2,3)11-7-10-12-8-5-4-6-9-12/h4-6,8-11H,1-3H3
InChIKey WLFZZBCFHRQUDI-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C13H16
Exact Mass 172.125201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J06iAyFQiWY
Name 4,4-dimethylpenta-1,2-dienylbenzene
Compound Number 5-(R1=PH,R2=T-BU,R3=H)
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16
InChI InChI=1S/C13H16/c1-13(2,3)11-7-10-12-8-5-4-6-9-12/h4-6,8-11H,1-3H3
InChIKey WLFZZBCFHRQUDI-UHFFFAOYSA-N
Literature Reference Author Y.NAGAOKA,K.TOMIOKA
Literature Reference Citation J.ORG.CHEM.,63,6428(1998)
Literature Reference DOI 10.1021/jo981028k
Molecular Weight 172.270 g/mol
Sample ID 37626
Solvent CDCl3