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3-(But-2-en-1-one-1-yl)coumarin
SpectraBase Compound ID BRU9Oqk3oDb
InChI InChI=1S/C13H10O3/c1-2-5-11(14)10-8-9-6-3-4-7-12(9)16-13(10)15/h2-8H,1H3/b5-2+
InChIKey KTOKHUUDSIGHPH-GORDUTHDSA-N
Mol Weight 214.22 g/mol
Molecular Formula C13H10O3
Exact Mass 214.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27txoqKvQYn
Name 3-(But-2-en-1-one-1-yl)coumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O3
InChI InChI=1S/C13H10O3/c1-2-5-11(14)10-8-9-6-3-4-7-12(9)16-13(10)15/h2-8H,1H3/b5-2+
InChIKey KTOKHUUDSIGHPH-GORDUTHDSA-N
Molecular Weight 214.220 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)C(\C=C\C)=O
SPLASH splash10-004i-9320000000-bc2f3c05328dae987d58
Source of Spectrum SO-0-860-4
Synonyms 3-(But-2-en-1-yl)coumarin 3-[(2E)-2-butenoyl]-2H-chromen-2-one
Wiley ID 1538257