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8-(4-Phenoxybutoxy)psoralen
SpectraBase Compound ID KZDjogtPUmd
InChI InChI=1S/C21H18O5/c22-18-9-8-15-14-16-10-13-25-19(16)21(20(15)26-18)24-12-5-4-11-23-17-6-2-1-3-7-17/h1-3,6-10,13-14H,4-5,11-12H2
InChIKey FIJVWSMVTCDFJN-UHFFFAOYSA-N
Mol Weight 350.37 g/mol
Molecular Formula C21H18O5
Exact Mass 350.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1OHNyImWH2
Name 8-(4-Phenoxybutoxy)psoralen
Alternate Name(s) 9-(4-phenoxybutoxy)-7-furo[3,2-g][1]benzopyranone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O5
InChI InChI=1S/C21H18O5/c22-18-9-8-15-14-16-10-13-25-19(16)21(20(15)26-18)24-12-5-4-11-23-17-6-2-1-3-7-17/h1-3,6-10,13-14H,4-5,11-12H2
InChIKey FIJVWSMVTCDFJN-UHFFFAOYSA-N
Molecular Weight 350.370 g/mol
SMILES C1(Oc2c(c3occc3cc2C=C1)OCCCCOc1ccccc1)=O
SPLASH splash10-0a4j-5900000000-549af48695f610402dad
Source of Spectrum F2-44-1848-38
Wiley ID 1716173