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4,2'-bis(Isopropyl)oxy-3-methoxy-5'-methylchalcone (isomer 1)

View entire compound with spectra: 1 NMR, and 1 FTIR

4,2'-bis(Isopropyl)oxy-3-methoxy-5'-methylchalcone (isomer 1)
SpectraBase Compound ID 3tKr0puGW71
InChI InChI=1S/C23H28O4/c1-15(2)26-21-11-7-17(5)13-19(21)20(24)10-8-18-9-12-22(27-16(3)4)23(14-18)25-6/h7-16H,1-6H3/b10-8+
InChIKey SVFMPRQNJCRQJF-CSKARUKUSA-N
Mol Weight 368.47 g/mol
Molecular Formula C23H28O4
Exact Mass 368.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H85i6BnS1hm
Name 4,2'-bis(Isopropyl)oxy-3-methoxy-5'-methylchalcone (isomer 1)
Comments Computed using HOSE algorithm
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Exact Mass 368.198759378 u
Formula C23H28O4
InChI InChI=1S/C23H28O4/c1-15(2)26-21-11-7-17(5)13-19(21)20(24)10-8-18-9-12-22(27-16(3)4)23(14-18)25-6/h7-16H,1-6H3/b10-8+
InChIKey SVFMPRQNJCRQJF-CSKARUKUSA-N
Molecular Weight 368.473 g/mol
SMILES C1(=C(C=CC(=C1)C)OC(C)C)C(\C=C\C=1C=CC(OC(C)C)=C(C1)OC)=O