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6-bromo-3-butyl-7-hydroxy-4-methyl-8-[(1-pyrrolidinyl)methyl]coumarin, hydrochloride

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

6-bromo-3-butyl-7-hydroxy-4-methyl-8-[(1-pyrrolidinyl)methyl]coumarin, hydrochloride
SpectraBase Compound ID 1KFVnf65IqP
InChI InChI=1S/C19H24BrNO3.ClH/c1-3-4-7-13-12(2)14-10-16(20)17(22)15(18(14)24-19(13)23)11-21-8-5-6-9-21;/h10,22H,3-9,11H2,1-2H3;1H
InChIKey MOEXTBWVBCIXEM-UHFFFAOYSA-N
Mol Weight 430.77 g/mol
Molecular Formula C19H25BrClNO3
Exact Mass 429.070634 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DtFBGp8SWYh
Name 6-BROMO-3-BUTYL-7-HYDROXY-4-METHYL-8-[(1-PYRROLIDINYL)METHYL]COUMARIN, HYDROCHLORIDE
Source of Sample A. Cascaval, Polytechnic Institute of Iassy, Iasi, Romania
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24BrNO + HCl
InChI InChI=1S/C19H24BrNO3.ClH/c1-3-4-7-13-12(2)14-10-16(20)17(22)15(18(14)24-19(13)23)11-21-8-5-6-9-21;/h10,22H,3-9,11H2,1-2H3;1H
InChIKey MOEXTBWVBCIXEM-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 198-199C (dec.)
Molecular Weight 430.78
Solvent Polysol; Reference=TMS; Temperature 297K