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4-Bromo-2-hydroxy-7-methoxycyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID GI0uZC7DWqz
InChI InChI=1S/C8H7BrO3/c1-12-7-3-2-5(9)4-6(10)8(7)11/h2-4H,1H3,(H,10,11)
InChIKey VOPHQFYWSLSLDU-UHFFFAOYSA-N
Mol Weight 231.04 g/mol
Molecular Formula C8H7BrO3
Exact Mass 229.957857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Lc6kx1l5KM
Name 4-Bromo-2-hydroxy-7-methoxycyclohepta-2,4,6-trien-1-one
CAS Registry Number 110076-79-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7BrO3
InChI InChI=1S/C8H7BrO3/c1-12-7-3-2-5(9)4-6(10)8(7)11/h2-4H,1H3,(H,10,11)
InChIKey VOPHQFYWSLSLDU-UHFFFAOYSA-N
Molecular Weight 231.045 g/mol
SMILES OC=1C(C(=CC=C(C1)Br)OC)=O
SPLASH splash10-0f8i-6590000000-7ea8fb409368cda78aef
Source of Spectrum J-52-4855-20
Synonyms 4-Bromo-2-hydroxy-7-methoxy-2,4,6-cycloheptatrien-1-one
Wiley ID 1231131