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HTmWfPzYQfN
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HTmWfPzYQfN
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13C NMR
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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(12E,14E,17E)-11-HYDROXY-12,14,17-DODECATRIENOIC-ACID-METHYLESTER
SpectraBase Compound ID BuvECuGsLC3
InChI InChI=1S/C21H36O3/c1-3-4-5-6-8-11-14-17-20(22)18-15-12-9-7-10-13-16-19-21(23)24-2/h4-5,8,11,14,17,20,22H,3,6-7,9-10,12-13,15-16,18-19H2,1-2H3/b5-4+,11-8+,17-14+
InChIKey XAGHXPSQGFWIRK-CITRGTOMSA-N
Mol Weight 336.5 g/mol
Molecular Formula C21H36O3
Exact Mass 336.266445 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HTmWfPzYQfN
Name (12E,14E,17E)-11-HYDROXY-12,14,17-DODECATRIENOIC-ACID-METHYLESTER
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36O3
InChI InChI=1S/C21H36O3/c1-3-4-5-6-8-11-14-17-20(22)18-15-12-9-7-10-13-16-19-21(23)24-2/h4-5,8,11,14,17,20,22H,3,6-7,9-10,12-13,15-16,18-19H2,1-2H3/b5-4+,11-8+,17-14+
InChIKey XAGHXPSQGFWIRK-CITRGTOMSA-N
Literature Reference Author M.TORI,Y.MUKAI,K.NAKASHIMA,M.SONO
Literature Reference Citation MOLECULES,8,882(2003)
Literature Reference DOI 10.3390/81200882
Molecular Weight 336.515 g/mol
Solvent CDCl3
Source File Reference UWMS5850
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