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5-Bromo-2-methoxycyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID 3S6lzOLkWFi
InChI InChI=1S/C8H7BrO2/c1-11-8-5-3-6(9)2-4-7(8)10/h2-5H,1H3
InChIKey MSEOPRICQZFYBP-UHFFFAOYSA-N
Mol Weight 215.05 g/mol
Molecular Formula C8H7BrO2
Exact Mass 213.962942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A4COXTuxj3a
Name 5-Bromo-2-methoxycyclohepta-2,4,6-trien-1-one
Alternate Name(s) 5-Bromanyl-2-methoxy-cyclohepta-2,4,6-trien-1-one 5-Bromo-2-methoxy-1-cyclohepta-2,4,6-trienone 5-Bromo-2-methoxy-2,4,6-cycloheptatrien-1-one
CAS Registry Number 33816-51-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7BrO2
InChI InChI=1S/C8H7BrO2/c1-11-8-5-3-6(9)2-4-7(8)10/h2-5H,1H3
InChIKey MSEOPRICQZFYBP-UHFFFAOYSA-N
Molecular Weight 215.046 g/mol
SMILES C=1(C(C=CC(=CC1)Br)=O)OC
SPLASH splash10-000i-0950000000-64e6f77bf71802307446
Source of Spectrum JA-50-395-0
Wiley ID 1212988