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2'-Isopropyloxy-3,4,4',5-tetramethoxychalcone (ISOMER1 )
SpectraBase Compound ID JZ9FFLQXxq1
InChI InChI=1S/C22H26O6/c1-14(2)28-19-13-16(24-3)8-9-17(19)18(23)10-7-15-11-20(25-4)22(27-6)21(12-15)26-5/h7-14H,1-6H3/b10-7+
InChIKey HDEMDHUBMRUGSP-JXMROGBWSA-N
Mol Weight 386.44 g/mol
Molecular Formula C22H26O6
Exact Mass 386.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtEt8iLQpVc
Name 2'-Isopropyloxy-3,4,4',5-tetramethoxychalcone (ISOMER1 )
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.172938551 u
Formula C22H26O6
InChI InChI=1S/C22H26O6/c1-14(2)28-19-13-16(24-3)8-9-17(19)18(23)10-7-15-11-20(25-4)22(27-6)21(12-15)26-5/h7-14H,1-6H3/b10-7+
InChIKey HDEMDHUBMRUGSP-JXMROGBWSA-N
Molecular Weight 386.444 g/mol
SMILES C1(=C(C=C(C=C1)OC)OC(C)C)C(\C=C\C=1C=C(OC)C(OC)=C(OC)C1)=O