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2-Pentenoic acid, 5-bromo-4-methoxy-, methyl ester, (Z)-(.+-.)-
SpectraBase Compound ID JUxNpS5QIMh
InChI InChI=1S/C7H11BrO3/c1-10-6(5-8)3-4-7(9)11-2/h3-4,6H,5H2,1-2H3/b4-3-
InChIKey FCEBCHYHKFAVJQ-ARJAWSKDSA-N
Mol Weight 223.07 g/mol
Molecular Formula C7H11BrO3
Exact Mass 221.989157 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Izlvsdi4LOH
Name 2-Pentenoic acid, 5-bromo-4-methoxy-, methyl ester, (Z)-(.+-.)-
Alternate Name(s) Methyl (2Z)-5-bromo-4-methoxy-2-pentenoate Methyl (Z)-5-bromo-4-methoxy-2-pentenoate
CAS Registry Number 85858-54-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11BrO3
InChI InChI=1S/C7H11BrO3/c1-10-6(5-8)3-4-7(9)11-2/h3-4,6H,5H2,1-2H3/b4-3-
InChIKey FCEBCHYHKFAVJQ-ARJAWSKDSA-N
Molecular Weight 223.066 g/mol
SMILES C(\C=C/C(OC)CBr)(=O)OC
SPLASH splash10-0h03-1900000000-61048116c55250a3e73c
Source of Spectrum F-38-2389-0
Wiley ID 1221664