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(S,Z)-2-(4-Bromobenzylidene)-3-(2-oxopropyl)-2H-furo[3,2-c]chromen-4(3H)-one
SpectraBase Compound ID J2SrtEYIYx8
InChI InChI=1S/C21H15BrO4/c1-12(23)10-16-18(11-13-6-8-14(22)9-7-13)25-20-15-4-2-3-5-17(15)26-21(24)19(16)20/h2-9,11,16H,10H2,1H3/b18-11-/t16-/m1/s1
InChIKey FWBGLGKURFFUKK-CJMVGXJBSA-N
Mol Weight 411.25 g/mol
Molecular Formula C21H15BrO4
Exact Mass 410.015372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CNSYsxzFji
Name (S,Z)-2-(4-Bromobenzylidene)-3-(2-oxopropyl)-2H-furo[3,2-c]chromen-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15BrO4
InChI InChI=1S/C21H15BrO4/c1-12(23)10-16-18(11-13-6-8-14(22)9-7-13)25-20-15-4-2-3-5-17(15)26-21(24)19(16)20/h2-9,11,16H,10H2,1H3/b18-11-/t16-/m1/s1
InChIKey FWBGLGKURFFUKK-CJMVGXJBSA-N
Literature Reference DOI 10.1021/ol502551u
Molecular Weight 411.251 g/mol
SMILES c1(\C=C\2[C@](C=3C(Oc4ccccc4C3O2)=O)(CC(C)=O)[H])ccc(cc1)Br
SPLASH splash10-0300-0329300000-25aba3b80eb14b3f021b
Source of Spectrum A1-16-5188/SM17-4c
Wiley ID 1751363