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Methyl 3-(4-bromo-2-thienyl)-4-nitrobutanoate
SpectraBase Compound ID CfAoGf5Iz32
InChI InChI=1S/C9H10BrNO4S/c1-15-9(12)2-6(4-11(13)14)8-3-7(10)5-16-8/h3,5-6H,2,4H2,1H3
InChIKey MALXGXQUBAOBMU-UHFFFAOYSA-N
Mol Weight 308.15 g/mol
Molecular Formula C9H10BrNO4S
Exact Mass 306.951392 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNQfolYSP49
Name Methyl 3-(4-bromo-2-thienyl)-4-nitrobutanoate
Alternate Name(s) Methyl 3-(4'-bromo-2'-thienyl)-4-nitrobutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10BrNO4S
InChI InChI=1S/C9H10BrNO4S/c1-15-9(12)2-6(4-11(13)14)8-3-7(10)5-16-8/h3,5-6H,2,4H2,1H3
InChIKey MALXGXQUBAOBMU-UHFFFAOYSA-N
Molecular Weight 308.146 g/mol
SMILES c1(cc(Br)cs1)C(CN(=O)=O)CC(=O)OC
SPLASH splash10-0ik9-0090000000-c0d6235d4ee0a801091b
Source of Spectrum JA-50-19-0
Wiley ID 1308751