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3',6'-bis[4'-(2"-Propynyloxy)spiro[phthalide-3,9'-xanthene]
SpectraBase Compound ID AiBKcIvSFqk
InChI InChI=1S/C26H16O5/c1-3-13-28-17-9-11-21-23(15-17)30-24-16-18(29-14-4-2)10-12-22(24)26(21)20-8-6-5-7-19(20)25(27)31-26/h1-2,5-12,15-16H,13-14H2
InChIKey BNEGALPNAGNGBR-UHFFFAOYSA-N
Mol Weight 408.41 g/mol
Molecular Formula C26H16O5
Exact Mass 408.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NWPaEcrYJA
Name 3',6'-bis[4'-(2"-Propynyloxy)spiro[phthalide-3,9'-xanthene]
Alternate Name(s) 3',6'-bis(prop-2-yn-1-yloxy)-3H-spiro[2-benzofuran-1,9'-xanthene]-3-one
CAS Registry Number 142457-79-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H16O5
InChI InChI=1S/C26H16O5/c1-3-13-28-17-9-11-21-23(15-17)30-24-16-18(29-14-4-2)10-12-22(24)26(21)20-8-6-5-7-19(20)25(27)31-26/h1-2,5-12,15-16H,13-14H2
InChIKey BNEGALPNAGNGBR-UHFFFAOYSA-N
Molecular Weight 408.409 g/mol
SMILES C12(OC(=O)c3c2cccc3)c2c(cc(cc2)OCC#C)Oc2c1ccc(OCC#C)c2
SPLASH splash10-06vi-0039000000-6051a92adb3ed168d474
Source of Spectrum K-125-2548-22
Wiley ID 1373113