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2H-Pyran, tetrahydro-2-[(17-methyl-4-tricosenyl)oxy]-, (4Z,17R)-
SpectraBase Compound ID GjALZjO5rEy
InChI InChI=1S/C29H56O2/c1-3-4-5-18-23-28(2)24-19-16-14-12-10-8-6-7-9-11-13-15-17-21-26-30-29-25-20-22-27-31-29/h13,15,28-29H,3-12,14,16-27H2,1-2H3/b15-13-/t28?,29-/m0/s1
InChIKey BDTHZIOJNOKBKT-XJAMYPFMSA-N
Mol Weight 436.8 g/mol
Molecular Formula C29H56O2
Exact Mass 436.428031 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5IBUA1AWAX6
Name 2H-Pyran, tetrahydro-2-[(17-methyl-4-tricosenyl)oxy]-, (4Z,17R)-
Comments Computed using HOSE algorithm
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Exact Mass 436.428031041 u
Formula C29H56O2
InChI InChI=1S/C29H56O2/c1-3-4-5-18-23-28(2)24-19-16-14-12-10-8-6-7-9-11-13-15-17-21-26-30-29-25-20-22-27-31-29/h13,15,28-29H,3-12,14,16-27H2,1-2H3/b15-13-/t28?,29-/m0/s1
InChIKey BDTHZIOJNOKBKT-XJAMYPFMSA-N
Molecular Weight 436.765 g/mol
SMILES [C@]1(OCCCC1)(OCCC\C=C/CCCCCCCCCCCC(CCCCCC)C)[H]