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3-(4'-Bromophenyl)-8-(2-oxopropoxy)coumarin
SpectraBase Compound ID BClInDdb342
InChI InChI=1S/C18H13BrO4/c1-11(20)10-22-16-4-2-3-13-9-15(18(21)23-17(13)16)12-5-7-14(19)8-6-12/h2-9H,10H2,1H3
InChIKey MMXORHLSRIBHAO-UHFFFAOYSA-N
Mol Weight 373.2 g/mol
Molecular Formula C18H13BrO4
Exact Mass 371.999722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17vvSvhtVg
Name 3-(4'-Bromophenyl)-8-(2-oxopropoxy)coumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13BrO4
InChI InChI=1S/C18H13BrO4/c1-11(20)10-22-16-4-2-3-13-9-15(18(21)23-17(13)16)12-5-7-14(19)8-6-12/h2-9H,10H2,1H3
InChIKey MMXORHLSRIBHAO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cmdc.201402205
Molecular Weight 373.202 g/mol
SMILES C1(Oc2c(cccc2C=C1c1ccc(cc1)Br)OCC(C)=O)=O
SPLASH splash10-00ai-0109000000-14e81bc981547a490694
Source of Spectrum CMC-9-2252-13
Synonyms 3-(4-bromophenyl)-8-(2-oxopropoxy)-2H-chromen-2-one
Wiley ID 1771853