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(E)-1-[3-(3-Bromo-4,5-dimethoxyphenyl)acryloyl]pyrrolidin-2-one
SpectraBase Compound ID Ba4SfG52irb
InChI InChI=1S/C15H16BrNO4/c1-20-12-9-10(8-11(16)15(12)21-2)5-6-14(19)17-7-3-4-13(17)18/h5-6,8-9H,3-4,7H2,1-2H3/b6-5+
InChIKey ZLELWEWPZNTXNW-AATRIKPKSA-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 ButyFIerpVs
Name (E)-1-[3-(3-Bromo-4,5-dimethoxyphenyl)acryloyl]pyrrolidin-2-one
Appearance Off-white solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.026270995 u
Formula C15H16BrNO4
InChI InChI=1S/C15H16BrNO4/c1-20-12-9-10(8-11(16)15(12)21-2)5-6-14(19)17-7-3-4-13(17)18/h5-6,8-9H,3-4,7H2,1-2H3/b6-5+
InChIKey ZLELWEWPZNTXNW-AATRIKPKSA-N
Instrument Name Thermo Finnigan MAT 8500
Ionization Type EI
Literature Reference DOI 10.1002/cmdc.202300132
Molecular Weight 354.200 g/mol
Quality 6
SMILES C1(=CC(=CC(=C1OC)OC)\C=C\C(N1C(CCC1)=O)=O)Br
SPLASH splash10-0q2c-0459000000-38cbb3e517e695fff3b4
Source of Spectrum CMC-18-8-3b (DOI: 10.1002/cmdc.202300132)
Thin-Layer Chromatography 0.40 (ethyl acetate/n-hexane, 1:1)
Wiley ID 1910312