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4'-Acetyltrioxsalen
SpectraBase Compound ID 9ZedLLlBDUE
InChI InChI=1S/C16H14O4/c1-7-5-13(18)20-15-8(2)16-12(6-11(7)15)14(9(3)17)10(4)19-16/h5-6H,1-4H3
InChIKey JXDPEOGAUHLCSN-UHFFFAOYSA-N
Mol Weight 270.28 g/mol
Molecular Formula C16H14O4
Exact Mass 270.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWwt8jYpd6o
Name 4'-Acetyltrioxsalen
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O4
InChI InChI=1S/C16H14O4/c1-7-5-13(18)20-15-8(2)16-12(6-11(7)15)14(9(3)17)10(4)19-16/h5-6H,1-4H3
InChIKey JXDPEOGAUHLCSN-UHFFFAOYSA-N
Molecular Weight 270.284 g/mol
SMILES c12c(c(C(=O)C)c(o2)C)cc2C(=CC(Oc2c1C)=O)C
SPLASH splash10-05fr-0090000000-bb0d29fe9242ce3b9e96
Source of Spectrum F4-40-3438-19
Synonyms 3-Acetyl-2,5,9-trimethyl-7-furo[3,2-g][1]benzopyranone 3-Acetyl-2,5,9-trimethylfuro[3,2-g]chromen-7-one 3-Ethanoyl-2,5,9-trimethyl-furo[3,2-g]chromen-7-one
Wiley ID 1671180