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14,15-Dinor-17-acetoxy-7-labden-13-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

14,15-Dinor-17-acetoxy-7-labden-13-one
SpectraBase Compound ID EB1gFmNMIXU
InChI InChI=1S/C20H32O3/c1-14-7-10-18-19(3,4)11-6-12-20(18,5)17(14)9-8-16(22)13-23-15(2)21/h7,17-18H,6,8-13H2,1-5H3/t17-,18?,20+/m0/s1
InChIKey XZQQXTUYLTURQZ-NKUTVCTDSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7IekFrsRIJf
Name 14,15-Dinor-17-acetoxy-7-labden-13-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.235144887 u
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-14-7-10-18-19(3,4)11-6-12-20(18,5)17(14)9-8-16(22)13-23-15(2)21/h7,17-18H,6,8-13H2,1-5H3/t17-,18?,20+/m0/s1
InChIKey XZQQXTUYLTURQZ-NKUTVCTDSA-N
Molecular Weight 320.473 g/mol
SMILES [C@]12(C(CC=C([C@@]2(CCC(=O)COC(=O)C)[H])C)C(C)(C)CCC1)C