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4-Bromo-1,6-methano[10]annulene-3-carboxylic acid
SpectraBase Compound ID CL6us1RMuHW
InChI InChI=1S/C12H9BrO2/c13-11-7-9-4-2-1-3-8(5-9)6-10(11)12(14)15/h1-4,6-7H,5H2,(H,14,15)
InChIKey WKJXXKUBPCOTIQ-UHFFFAOYSA-N
Mol Weight 265.11 g/mol
Molecular Formula C12H9BrO2
Exact Mass 263.978593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UpGLkJV4DJ
Name 4-Bromo-1,6-methano[10]annulene-3-carboxylic acid
Alternate Name(s) 4-Bromobicyclo[4.4.1]undeca-1(10),2,4,6,8-pentaene-3-carboxylic acid
CAS Registry Number 142797-67-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrO2
InChI InChI=1S/C12H9BrO2/c13-11-7-9-4-2-1-3-8(5-9)6-10(11)12(14)15/h1-4,6-7H,5H2,(H,14,15)
InChIKey WKJXXKUBPCOTIQ-UHFFFAOYSA-N
Molecular Weight 265.106 g/mol
SMILES OC(C=1C(=CC2=CC=CC=C(C1)C2)Br)=O
SPLASH splash10-000i-0970000000-423d0b2a2e004122fddb
Source of Spectrum K-125-2229-10
Wiley ID 1267534