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(S)-(Z)-1-(1-Hydroxy-pentyl)-2-pentyl-cyclododecene
SpectraBase Compound ID C2QOgRvNNm2
InChI InChI=1S/C22H42O/c1-3-5-13-16-20-17-14-11-9-7-8-10-12-15-18-21(20)22(23)19-6-4-2/h22-23H,3-19H2,1-2H3/b21-20+
InChIKey RTNCFAACZMOISN-QZQOTICOSA-N
Mol Weight 322.6 g/mol
Molecular Formula C22H42O
Exact Mass 322.323566 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H5Qt0Mt774P
Name (S)-(Z)-1-(1-Hydroxy-pentyl)-2-pentyl-cyclododecene
Comments reassigned
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Formula C22H42O
InChI InChI=1S/C22H42O/c1-3-5-13-16-20-17-14-11-9-7-8-10-12-15-18-21(20)22(23)19-6-4-2/h22-23H,3-19H2,1-2H3/b21-20+
InChIKey RTNCFAACZMOISN-QZQOTICOSA-N
Instrument Name IBM NR-80
Literature Reference J.A. Marshall, K.E. Flynn, J. Am. Chem. Soc. 106, 723 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3