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6-bromo-3-butyl-7-hydroxy-4-methylcoumarin, butyrate

View entire compound with spectra: 2 NMR, and 1 FTIR

6-bromo-3-butyl-7-hydroxy-4-methylcoumarin, butyrate
SpectraBase Compound ID Ds0UOxgJlEH
InChI InChI=1S/C18H21BrO4/c1-4-6-8-12-11(3)13-9-14(19)16(22-17(20)7-5-2)10-15(13)23-18(12)21/h9-10H,4-8H2,1-3H3
InChIKey HUOHFEBBUJOZTI-UHFFFAOYSA-N
Mol Weight 381.27 g/mol
Molecular Formula C18H21BrO4
Exact Mass 380.062322 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KH3LWkR1pa7
Name 6-BROMO-3-BUTYL-7-HYDROXY-4-METHYLCOUMARIN, BUTYRATE
Source of Sample A. Cascaval, Polytechnic Institute of Iassy, Iasi, Romania
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21BrO4
InChI InChI=1S/C18H21BrO4/c1-4-6-8-12-11(3)13-9-14(19)16(22-17(20)7-5-2)10-15(13)23-18(12)21/h9-10H,4-8H2,1-3H3
InChIKey HUOHFEBBUJOZTI-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 94-95C
Molecular Weight 381.27
Solvent CDCl3; Reference=TMS; Temperature 297K