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2-(3,4-di(Isopropyl)oxyphenyl)-2,3-dihydro-5-hydroxy,7-(isopropyl)oxy-4H-1-benzopyran-4-one

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2-(3,4-di(Isopropyl)oxyphenyl)-2,3-dihydro-5-hydroxy,7-(isopropyl)oxy-4H-1-benzopyran-4-one
SpectraBase Compound ID D0Bd50Z69LQ
InChI InChI=1S/C24H30O6/c1-13(2)27-17-10-18(25)24-19(26)12-21(30-23(24)11-17)16-7-8-20(28-14(3)4)22(9-16)29-15(5)6/h7-11,13-15,21,25H,12H2,1-6H3
InChIKey VARFPFNNDHTRBI-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C24H30O6
Exact Mass 414.204239 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID W19m2jZmaM
Name 2-(3,4-di(Isopropyl)oxyphenyl)-2,3-dihydro-5-hydroxy,7-(isopropyl)oxy-4H-1-benzopyran-4-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.204238680 u
Formula C24H30O6
InChI InChI=1S/C24H30O6/c1-13(2)27-17-10-18(25)24-19(26)12-21(30-23(24)11-17)16-7-8-20(28-14(3)4)22(9-16)29-15(5)6/h7-11,13-15,21,25H,12H2,1-6H3
InChIKey VARFPFNNDHTRBI-UHFFFAOYSA-N
Molecular Weight 414.498 g/mol
SMILES C1=C(C(OC(C)C)=CC=C1C1CC(C2=C(C=C(C=C2O)OC(C)C)O1)=O)OC(C)C