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4-Methyl-1,2,5-hexatriene
SpectraBase Compound ID I3vaeMBdoDx
InChI InChI=1S/C7H10/c1-4-6-7(3)5-2/h5-7H,1-2H2,3H3
InChIKey VBLWHEPXKDBVGG-UHFFFAOYSA-N
Mol Weight 95.16 g/mol
Molecular Formula C7H11
Exact Mass 95.086075 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AZ7aXscsyVo
Name 4-METHYL-1,2,5-HEXATRIENE
CAS Registry Number 137670-03-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10
InChI InChI=1S/C7H10/c1-4-6-7(3)5-2/h5-7H,1-2H2,3H3
InChIKey VBLWHEPXKDBVGG-UHFFFAOYSA-N
Literature Reference Author H.HOPF,G.WACHHOLZ,R.WALSH
Literature Reference Citation CHEM.BER.,125,711(1992)
Literature Reference DOI 10.1002/cber.19921250326
Molecular Weight 94.156 g/mol
Solvent CDCl3
Source File Reference UWCS6667