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5-Methoxy-4-methyl-8-(4-phenoxybutoxy)psoralen
SpectraBase Compound ID 6EXXkUqHiEu
InChI InChI=1S/C23H22O6/c1-15-14-18(24)29-22-19(15)20(25-2)17-10-13-28-21(17)23(22)27-12-7-6-11-26-16-8-4-3-5-9-16/h3-5,8-10,13-14H,6-7,11-12H2,1-2H3
InChIKey YBCXPJFFTXDYAK-UHFFFAOYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JiirhXDGhwH
Name 5-Methoxy-4-methyl-8-(4-phenoxybutoxy)psoralen
Alternate Name(s) 4-Methoxy-5-methyl-9-(4-phenoxybutoxy)-7-furo[3,2-g][1]benzopyranone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-15-14-18(24)29-22-19(15)20(25-2)17-10-13-28-21(17)23(22)27-12-7-6-11-26-16-8-4-3-5-9-16/h3-5,8-10,13-14H,6-7,11-12H2,1-2H3
InChIKey YBCXPJFFTXDYAK-UHFFFAOYSA-N
Molecular Weight 394.423 g/mol
SMILES C1(Oc2c(c3occc3c(c2C(=C1)C)OC)OCCCCOc1ccccc1)=O
SPLASH splash10-052b-3910000000-54f06cf21fcbd527c5e6
Source of Spectrum F2-44-1850-63
Wiley ID 1716166