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Isopropyl 2-bromo-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate

View entire compound with spectra: 2 MS (GC)

Isopropyl 2-bromo-4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoate
SpectraBase Compound ID GmPCkhnHutl
InChI InChI=1S/C15H16BrNO4/c1-9(2)21-15(20)12(16)7-8-17-13(18)10-5-3-4-6-11(10)14(17)19/h3-6,9,12H,7-8H2,1-2H3
InChIKey LLBGGTDJNGEUJJ-UHFFFAOYSA-N
Mol Weight 354.2 g/mol
Molecular Formula C15H16BrNO4
Exact Mass 353.026271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALLHnDnwaEo
Name 2H-ISOINDOLE-2-BUTANOIC ACID, alpha-BROMO-1,3-DIHYDRO-1,3-DIOXO-, 1-METHYLETHYL ESTER, (.+-.)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H16NO4Br
InChI InChI=1S/C15H16BrNO4/c1-9(2)21-15(20)12(16)7-8-17-13(18)10-5-3-4-6-11(10)14(17)19/h3-6,9,12H,7-8H2,1-2H3
InChIKey LLBGGTDJNGEUJJ-UHFFFAOYSA-N
Molecular Weight 353.0258
SMILES c1cc2C(=O)N(CCC(C(OC(C)C)=O)Br)C(=O)c2cc1
SPLASH splash10-03di-3930000000-e263f02226842afb5a09
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany