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4-Hydroxy-4,¹¹b-dimethyltetradecahydro-6A,9-methanocyclohepta[A]naphthalene-8-carboxylic acid, methyl ester

View entire compound with spectra: 1 NMR

4-Hydroxy-4,¹¹b-dimethyltetradecahydro-6A,9-methanocyclohepta[A]naphthalene-8-carboxylic acid, methyl ester
SpectraBase Compound ID 1zdZnMn5gFc
InChI InChI=1S/C20H32O3/c1-18-8-4-9-19(2,22)15(18)7-10-20-11-13(5-6-16(18)20)14(12-20)17(21)23-3/h13-16,22H,4-12H2,1-3H3
InChIKey VFGNIWFPXSNVLI-UHFFFAOYSA-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 DNYQ8RPDMc8
Name 4-Hydroxy-4,¹¹b-dimethyltetradecahydro-6A,9-methanocyclohepta[A]naphthalene-8-carboxylic acid, methyl ester
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/c1-18-8-4-9-19(2,22)15(18)7-10-20-11-13(5-6-16(18)20)14(12-20)17(21)23-3/h13-16,22H,4-12H2,1-3H3
InChIKey VFGNIWFPXSNVLI-UHFFFAOYSA-N
Molecular Weight 320.473 g/mol
SMILES C1CC(C2C(C1)(C1CCC3CC1(CC2)CC3C(OC)=O)C)(C)O