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acetamido(3-bromo-4-fluorobenzyl)malonic acid, diethyl ester
SpectraBase Compound ID BxI6pbKYDPz
InChI InChI=1S/C16H19BrFNO5/c1-4-23-14(21)16(19-10(3)20,15(22)24-5-2)9-11-6-7-13(18)12(17)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,20)
InChIKey BHTYMOXEQVTOED-UHFFFAOYSA-N
Mol Weight 404.23 g/mol
Molecular Formula C16H19BrFNO5
Exact Mass 403.043064 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID JWWy6JmrFE6
Name ACETAMIDO(3-BROMO-4-FLUOROBENZYL)MALONIC ACID, DIETHYL ESTER
Source of Sample J. I. Degraw & M. Cory, Stanford Research Institute, Menlo Park, California
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19BrFNO5
InChI InChI=1S/C16H19BrFNO5/c1-4-23-14(21)16(19-10(3)20,15(22)24-5-2)9-11-6-7-13(18)12(17)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,20)
InChIKey BHTYMOXEQVTOED-UHFFFAOYSA-N
Literature Reference JMCH 10, 64(1967)
Melting Point 118-119.5C
Molecular Weight 404.239990
Synonyms MALONIC ACID, ACETAMIDO/3-BROMO-4- FLUOROBENZYL/-, DIETHYL ESTER
Technique KBr WAFER