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4-Hydroxy-3-(2-methylbut-3-yn-2-yloxy)-9H-xanthen-9-one
SpectraBase Compound ID 2VWx3XIwBfT
InChI InChI=1S/C18H14O4/c1-4-18(2,3)22-14-10-9-12-15(19)11-7-5-6-8-13(11)21-17(12)16(14)20/h1,5-10,20H,2-3H3
InChIKey ZYPXCEZEYFLBJH-UHFFFAOYSA-N
Mol Weight 294.31 g/mol
Molecular Formula C18H14O4
Exact Mass 294.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID yxd7PYbA1V
Name 4-Hydroxy-3-(2-methylbut-3-yn-2-yloxy)-9H-xanthen-9-one
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O4
InChI InChI=1S/C18H14O4/c1-4-18(2,3)22-14-10-9-12-15(19)11-7-5-6-8-13(11)21-17(12)16(14)20/h1,5-10,20H,2-3H3
InChIKey ZYPXCEZEYFLBJH-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-2010
Ionization Type EI
Literature Reference DOI 10.1021/jm301593r
Molecular Weight 294.306 g/mol
SMILES Oc1c2c(ccc1OC(C#C)(C)C)C(c1c(cccc1)O2)=O
SPLASH splash10-0a4i-9040000000-f88482be5ecd967f43b5
Source of Spectrum AF-56-SM4-9a
Wiley ID 1854512