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Methyl 3,4,4a,5,6,7,8,8a-octahydro-8a-methyl-6-(phenylmethoxy)naphthalene-1-carboxylate

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

Methyl 3,4,4a,5,6,7,8,8a-octahydro-8a-methyl-6-(phenylmethoxy)naphthalene-1-carboxylate
SpectraBase Compound ID 5vaaHDa2cYY
InChI InChI=1S/C20H26O3/c1-20-12-11-17(23-14-15-7-4-3-5-8-15)13-16(20)9-6-10-18(20)19(21)22-2/h3-5,7-8,10,16-17H,6,9,11-14H2,1-2H3
InChIKey LXZGPTHVSKDALA-UHFFFAOYSA-N
Mol Weight 314.43 g/mol
Molecular Formula C20H26O3
Exact Mass 314.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JIMbqxoMn3s
Name Methyl 3,4,4A,5,6,7,8,8A-octahydro-8A-methyl-6-(phenylmethoxy)naphthalene-1-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.188194694 u
Formula C20H26O3
InChI InChI=1S/C20H26O3/c1-20-12-11-17(23-14-15-7-4-3-5-8-15)13-16(20)9-6-10-18(20)19(21)22-2/h3-5,7-8,10,16-17H,6,9,11-14H2,1-2H3
InChIKey LXZGPTHVSKDALA-UHFFFAOYSA-N
SMILES C1(=CCCC2CC(CCC12C)OCC=1C=CC=CC1)C(=O)OC