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3-Bromo-4-(1,3-dioxoisoindolin-2-yl)hexyl 4-chlorobenzoate
SpectraBase Compound ID 8RPW52RsSd8
InChI InChI=1S/C21H19BrClNO4/c1-2-18(24-19(25)15-5-3-4-6-16(15)20(24)26)17(22)11-12-28-21(27)13-7-9-14(23)10-8-13/h3-10,17-18H,2,11-12H2,1H3
InChIKey GXBISSORRXDOMT-UHFFFAOYSA-N
Mol Weight 464.74 g/mol
Molecular Formula C21H19BrClNO4
Exact Mass 463.018599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tPtt6qHs8f
Name 3-Bromo-4-(1,3-dioxoisoindolin-2-yl)hexyl 4-chlorobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19BrClNO4
InChI InChI=1S/C21H19BrClNO4/c1-2-18(24-19(25)15-5-3-4-6-16(15)20(24)26)17(22)11-12-28-21(27)13-7-9-14(23)10-8-13/h3-10,17-18H,2,11-12H2,1H3
InChIKey GXBISSORRXDOMT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19983400205
Molecular Weight 464.743 g/mol
SMILES c1ccc2C(N(C(c2c1)=O)C(CC)C(Br)CCOC(=O)c1ccc(cc1)Cl)=O
SPLASH splash10-000i-1900000000-95673a507f472ea419da
Source of Spectrum JF-340-133-6k
Wiley ID 1766546