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3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohex-2-en-1-one 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxy-phenyl]methyl]-5,5-dimethyl-cyclohex-2-en-1-one 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethyl-1-cyclohex-2-enone 3-hydroxy-2-[(2-hydroxy-6-keto-4,4-dimethyl-1-cyclohexenyl)-(4-methoxy-3-methylol-phenyl)methyl]-5,5-dimethyl-cyclohex-2-en-1-one
SpectraBase Compound ID EjctrtfWQNK
InChI InChI=1S/C25H32O6/c1-24(2)9-16(27)22(17(28)10-24)21(14-6-7-20(31-5)15(8-14)13-26)23-18(29)11-25(3,4)12-19(23)30/h6-8,21,26-27,29H,9-13H2,1-5H3
InChIKey OMMOUKYGZUMZAN-UHFFFAOYSA-N
Mol Weight 428.5 g/mol
Molecular Formula C25H32O6
Exact Mass 428.219889 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ZLSyXLdzDm
Name 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethylcyclohex-2-en-1-one 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxy-phenyl]methyl]-5,5-dimethyl-cyclohex-2-en-1-one 3-hydroxy-2-[(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-[3-(hydroxymethyl)-4-methoxyphenyl]methyl]-5,5-dimethyl-1-cyclohex-2-enone 3-hydroxy-2-[(2-hydroxy-6-keto-4,4-dimethyl-1-cyclohexenyl)-(4-methoxy-3-methylol-phenyl)methyl]-5,5-dimethyl-cyclohex-2-en-1-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 428.219888744 u
Formula C25H32O6
InChI InChI=1S/C25H32O6/c1-24(2)9-16(27)22(17(28)10-24)21(14-6-7-20(31-5)15(8-14)13-26)23-18(29)11-25(3,4)12-19(23)30/h6-8,21,26-27,29H,9-13H2,1-5H3
InChIKey OMMOUKYGZUMZAN-UHFFFAOYSA-N
Molecular Weight 428.525 g/mol
NMR Offset 17.988
NMR Spectrometer Frequency 500.132
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17891
Solvent CDCl3
Source Vendor ID: NMR/11220672; Lab Info: HAC; Lab Number: HAC-nal0081