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(4aR-(4a.alpha.,6a.alpha.,12a.alpha.,12b.beta.)-1,3,4,4a,5,6,6a,12,12a,12b-Decahydro-4,4,6a,12b-tetramethyl-2H-benzo(0)xanthen-10-ol acetate

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

(4aR-(4a.alpha.,6a.alpha.,12a.alpha.,12b.beta.)-1,3,4,4a,5,6,6a,12,12a,12b-Decahydro-4,4,6a,12b-tetramethyl-2H-benzo(0)xanthen-10-ol acetate
SpectraBase Compound ID LigpTVohF9u
InChI InChI=1S/C23H32O3/c1-15(24)25-17-7-8-18-16(13-17)14-20-22(4)11-6-10-21(2,3)19(22)9-12-23(20,5)26-18/h7-8,13,19-20H,6,9-12,14H2,1-5H3
InChIKey IRIRWEACXZOQKC-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C23H32O3
Exact Mass 356.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K30OROud6NW
Name (4ar-(4A.alpha.,6A.alpha.,12A.alpha.,12B.beta.)-1,3,4,4A,5,6,6A,12,12A,12B-Decahydro-4,4,6A,12B-tetramethyl-2H-benzo(0)xanthen-10-ol acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.235144887 u
Formula C23H32O3
InChI InChI=1S/C23H32O3/c1-15(24)25-17-7-8-18-16(13-17)14-20-22(4)11-6-10-21(2,3)19(22)9-12-23(20,5)26-18/h7-8,13,19-20H,6,9-12,14H2,1-5H3
InChIKey IRIRWEACXZOQKC-UHFFFAOYSA-N
Molecular Weight 356.506 g/mol
SMILES C12(C3C(OC=4C(C3)=CC(OC(=O)C)=CC4)(C)CCC2C(C)(C)CCC1)C