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4'-Bromo-2',3'-dimethyl-2'-butenyl 2-Propynoate
SpectraBase Compound ID 68V5zN8yc20
InChI InChI=1S/C9H11BrO2/c1-4-9(11)12-6-8(3)7(2)5-10/h1H,5-6H2,2-3H3/b8-7+
InChIKey RMYZOPIKUJZNOP-BQYQJAHWSA-N
Mol Weight 231.09 g/mol
Molecular Formula C9H11BrO2
Exact Mass 229.994243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVotcKjp2BI
Name 4'-Bromo-2',3'-dimethyl-2'-butenyl 2-Propynoate
CAS Registry Number 129178-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11BrO2
InChI InChI=1S/C9H11BrO2/c1-4-9(11)12-6-8(3)7(2)5-10/h1H,5-6H2,2-3H3/b8-7+
InChIKey RMYZOPIKUJZNOP-BQYQJAHWSA-N
Molecular Weight 231.089 g/mol
SMILES C(C(OC\C(=C\(CBr)C)C)=O)#C
SPLASH splash10-0udi-9500000000-6b014d91829b22b14fa8
Source of Spectrum J-56-5124-1
Synonyms (2E)-4-bromo-2,3-dimethyl-2-butenyl propiolate
Wiley ID 1231210