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6-bromo-3-butyl-7-hydroxy-4-methyl-8-(piperidinomethyl)coumarin, hydrochloride

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

6-bromo-3-butyl-7-hydroxy-4-methyl-8-(piperidinomethyl)coumarin, hydrochloride
SpectraBase Compound ID 5wuL694TPFP
InChI InChI=1S/C20H26BrNO3.ClH/c1-3-4-8-14-13(2)15-11-17(21)18(23)16(19(15)25-20(14)24)12-22-9-6-5-7-10-22;/h11,23H,3-10,12H2,1-2H3;1H
InChIKey OBJFIEDXIQZNNQ-UHFFFAOYSA-N
Mol Weight 444.8 g/mol
Molecular Formula C20H27BrClNO3
Exact Mass 443.086284 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9D9YuUAhb6
Name 6-BROMO-3-BUTYL-7-HYDROXY-4-METHYL-8-(PIPERIDINOMETHYL)COUMARIN, HYDROCHLORIDE
Source of Sample A. CASCAVAL, POLYTECHNIC INSTITUTE OF IASSY, IASI, ROMANIA
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27BrClNO3
InChI InChI=1S/C20H26BrNO3.ClH/c1-3-4-8-14-13(2)15-11-17(21)18(23)16(19(15)25-20(14)24)12-22-9-6-5-7-10-22;/h11,23H,3-10,12H2,1-2H3;1H
InChIKey OBJFIEDXIQZNNQ-UHFFFAOYSA-N
Melting Point 152-153C
Molecular Weight 444.799988
Synonyms COUMARIN, 6-BROMO-3-BUTYL- 7-HYDROXY-4-METHYL-8-/PIPERIDINO- METHYL/-, HYDROCHLORIDE
Technique KBr WAFER