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Ethyl (E)-3-Bromo-3-cyanoprop-2-enoate
SpectraBase Compound ID 6JgksIpWh12
InChI InChI=1S/C6H6BrNO2/c1-2-10-6(9)3-5(7)4-8/h3H,2H2,1H3/b5-3+
InChIKey XLAMYVJGCVYTEZ-HWKANZROSA-N
Mol Weight 204.02 g/mol
Molecular Formula C6H6BrNO2
Exact Mass 202.958191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DNnn0QZmo3A
Name Ethyl (E)-3-Bromo-3-cyanoprop-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H6BrNO2
InChI InChI=1S/C6H6BrNO2/c1-2-10-6(9)3-5(7)4-8/h3H,2H2,1H3/b5-3+
InChIKey XLAMYVJGCVYTEZ-HWKANZROSA-N
Instrument Name Shimadzu GC-MSQP5050A
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.202000394
Molecular Weight 204.023 g/mol
SMILES C(\C=C/(Br)C#N)(OCC)=O
SPLASH splash10-114i-5900000000-9c0247972eb6e3d6eee8
Source of Spectrum U1-2020-4133-(E)-4b
Wiley ID 1860802