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4-[3-(4-Methylphenoxy)propoxy]-7H-furo[3,2-g][1]benzopyran-7-one
SpectraBase Compound ID FsdZonYntge
InChI InChI=1S/C21H18O5/c1-14-3-5-15(6-4-14)23-10-2-11-25-21-16-7-8-20(22)26-19(16)13-18-17(21)9-12-24-18/h3-9,12-13H,2,10-11H2,1H3
InChIKey HWKDGGOLEMACFV-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 HtpmtFpvhUi
Name 4-[3-(4-Methylphenoxy)propoxy]-7H-furo[3,2-g][1]benzopyran-7-one
Alternate Name(s) 5-[3(4-Methylphenoxy)propoxy]psoralen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18O5
InChI InChI=1S/C21H18O5/c1-14-3-5-15(6-4-14)23-10-2-11-25-21-16-7-8-20(22)26-19(16)13-18-17(21)9-12-24-18/h3-9,12-13H,2,10-11H2,1H3
InChIKey HWKDGGOLEMACFV-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 350.370 g/mol
SMILES c1(OCCCOc2ccc(cc2)C)c2C=CC(=O)Oc2cc2occc12
SPLASH splash10-0fkd-3921000000-b9dec2acf28433b6f7b6
Source of Spectrum US20100121059A1
Wiley ID 1842293