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4-(4-Benzyloxybutoxy)-7H-furo[3,2-g][1]benzopyran-7-one
SpectraBase Compound ID KDe6pkkknm8
InChI InChI=1S/C22H20O5/c23-21-9-8-17-20(27-21)14-19-18(10-13-25-19)22(17)26-12-5-4-11-24-15-16-6-2-1-3-7-16/h1-3,6-10,13-14H,4-5,11-12,15H2
InChIKey HMOVAWBSEVWMGS-UHFFFAOYSA-N
Mol Weight 364.4 g/mol
Molecular Formula C22H20O5
Exact Mass 364.131074 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FlT83OuQqI9
Name 4-(4-Benzyloxybutoxy)-7H-furo[3,2-g][1]benzopyran-7-one
Alternate Name(s) 5-(4-Benzyloxybutoxy)psoralen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O5
InChI InChI=1S/C22H20O5/c23-21-9-8-17-20(27-21)14-19-18(10-13-25-19)22(17)26-12-5-4-11-24-15-16-6-2-1-3-7-16/h1-3,6-10,13-14H,4-5,11-12,15H2
InChIKey HMOVAWBSEVWMGS-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 364.397 g/mol
SMILES c12c(c3c(cc2occ1)OC(C=C3)=O)OCCCCOCc1ccccc1
SPLASH splash10-0006-9113000000-a8eb0256bcf4ae94d444
Source of Spectrum US20100121059A1
Wiley ID 1842317