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(MeO)3-[Go]-[Ca]

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

(MeO)3-[Go]-[Ca]
SpectraBase Compound ID 1dnvh8hO1ee
InChI InChI=1S/C36H50O6/c1-27(41-24-32-16-10-29(11-17-32)21-38-6)34(26-40-23-31-14-8-28(9-15-31)20-37-5)35(36(2,3)4)42-25-33-18-12-30(13-19-33)22-39-7/h8-19,27,34-35H,20-26H2,1-7H3/t27-,34+,35-/m1/s1
InChIKey SLACTQCNYSFWTB-MUQYBZNMSA-N
Mol Weight 578.8 g/mol
Molecular Formula C36H50O6
Exact Mass 578.360739 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JyUzmJsNqnK
Name (meo)3-[go]-[ca]
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 578.360739324 u
Formula C36H50O6
InChI InChI=1S/C36H50O6/c1-27(41-24-32-16-10-29(11-17-32)21-38-6)34(26-40-23-31-14-8-28(9-15-31)20-37-5)35(36(2,3)4)42-25-33-18-12-30(13-19-33)22-39-7/h8-19,27,34-35H,20-26H2,1-7H3/t27-,34+,35-/m1/s1
InChIKey SLACTQCNYSFWTB-MUQYBZNMSA-N
Molecular Weight 578.790 g/mol
SMILES C=1C(=CC=C(C1)CO[C@](C)([C@@]([C@@](OCC1=CC=C(C=C1)COC)(C(C)(C)C)[H])(COCC1=CC=C(C=C1)COC)[H])[H])COC