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Benzenepropanoic acid, 2-chloro-4-fluoro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)-alpha,alpha-dimethyl-, 3-methylbutyl ester

View entire compound with spectra: 1 FTIR

Benzenepropanoic acid, 2-chloro-4-fluoro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)-alpha,alpha-dimethyl-, 3-methylbutyl ester
SpectraBase Compound ID LXSyYmduHZ9
InChI InChI=1S/C24H29ClFNO4/c1-14(2)9-10-31-23(30)24(3,4)13-15-11-20(19(26)12-18(15)25)27-21(28)16-7-5-6-8-17(16)22(27)29/h11-12,14H,5-10,13H2,1-4H3
InChIKey XBOKROZBOAQZDK-UHFFFAOYSA-N
Mol Weight 449.95 g/mol
Molecular Formula C24H29ClFNO4
Exact Mass 449.176914 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID AftmXZB5mn9
Name Benzenepropanoic acid, 2-chloro-4-fluoro-5-(1,3,4,5,6,7-hexahydro-1,3-dioxo-2H-isoindol-2-yl)-alpha,alpha-dimethyl-, 3-methylbutyl ester
CAS Registry Number 121482-12-0
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C24H29ClFNO4
InChI InChI=1S/C24H29ClFNO4/c1-14(2)9-10-31-23(30)24(3,4)13-15-11-20(19(26)12-18(15)25)27-21(28)16-7-5-6-8-17(16)22(27)29/h11-12,14H,5-10,13H2,1-4H3
InChIKey XBOKROZBOAQZDK-UHFFFAOYSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Technique KBr-Pellet