John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=KwMQGsHEAeK SpectraBase Spectrum ID=2VpVmugTMgO

(accessed ).
1-ACETOXY-3-ANGELOYLOXY-(4-E,6-E)-TETRADECA-4,6-DIEN-8,10,12-TRIYNE
SpectraBase Compound ID KwMQGsHEAeK
InChI InChI=1S/C21H22O4/c1-5-7-8-9-10-11-12-13-14-15-20(16-17-24-19(4)22)25-21(23)18(3)6-2/h6,12-15,20H,16-17H2,1-4H3/b13-12+,15-14+,18-6+
InChIKey QHZNYIUZHDAGDF-VPZZMWNWSA-N
Mol Weight 338.4 g/mol
Molecular Formula C21H22O4
Exact Mass 338.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VpVmugTMgO
Name 1-ACETOXY-3-ANGELOYLOXY-(4-E,6-E)-TETRADECA-4,6-DIEN-8,10,12-TRIYNE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O4
InChI InChI=1S/C21H22O4/c1-5-7-8-9-10-11-12-13-14-15-20(16-17-24-19(4)22)25-21(23)18(3)6-2/h6,12-15,20H,16-17H2,1-4H3/b13-12+,15-14+,18-6+
InChIKey QHZNYIUZHDAGDF-VPZZMWNWSA-N
Literature Reference Author S.SCHWAIGER,M.ADAMS,C.SEGER,E.P.ELLMERER,R.BAUER,H.STUPPNER
Literature Reference Citation PLANTA.MED.,70,978(2004)
Literature Reference DOI 10.1055/s-2004-832625
Molecular Weight 338.403 g/mol
Solvent CDCl3
Source File Reference UWMZ48526
SpectraBase Batch ID JMgpOcLiTl4