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3-bromo-7-methoxy-4-(phenylethynyl)-2H-chromen-2-one
SpectraBase Compound ID JAfu4hQ6BfM
InChI InChI=1S/C18H11BrO3/c1-21-13-8-10-14-15(9-7-12-5-3-2-4-6-12)17(19)18(20)22-16(14)11-13/h2-6,8,10-11H,1H3
InChIKey JXFMLZIRKPEJLN-UHFFFAOYSA-N
Mol Weight 355.19 g/mol
Molecular Formula C18H11BrO3
Exact Mass 353.989157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3BudRqrWEa
Name 3-bromo-7-methoxy-4-(phenylethynyl)-2H-chromen-2-one
Appearance Off white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H11BrO3
InChI InChI=1S/C18H11BrO3/c1-21-13-8-10-14-15(9-7-12-5-3-2-4-6-12)17(19)18(20)22-16(14)11-13/h2-6,8,10-11H,1H3
InChIKey JXFMLZIRKPEJLN-UHFFFAOYSA-N
Instrument Name Waters CAB155 GCT Premier
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202100279
Molecular Weight 355.187 g/mol
SMILES c1(OC)ccc2c(c1)OC(C(=C2C#Cc1ccccc1)Br)=O
SPLASH splash10-1029-5947000000-96955a3875e0b08fde2c
Source of Spectrum AJO-10-SM84-3.8
Wiley ID 1866391