John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=JqmshwCetKr SpectraBase Spectrum ID=2bnVNv13cna

(accessed ).
(trans)-1,2,5-heptatriene
SpectraBase Compound ID JqmshwCetKr
InChI InChI=1S/C7H10/c1-3-5-7-6-4-2/h4-6H,1,7H2,2H3/b6-4+
InChIKey FVIAULWVNHZLBQ-GQCTYLIASA-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 2bnVNv13cna
Name TRANS-1,2,5-HEPTATRIENE
CAS Registry Number 137670-05-4
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10
InChI InChI=1S/C7H10/c1-3-5-7-6-4-2/h4-6H,1,7H2,2H3/b6-4+
InChIKey FVIAULWVNHZLBQ-GQCTYLIASA-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 UWCS6668
SpectraBase Batch ID BM3GUQtULta