Debug Info

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CqZ8ohRedDv
spectrumID
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CqZ8ohRedDv
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Mass Spectrum (GC)
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1-(Bromomethyl)-3-chloranyl-2-methyl-benzene
SpectraBase Compound ID KvqXM5iX1c6
InChI InChI=1S/C8H8BrCl/c1-6-7(5-9)3-2-4-8(6)10/h2-4H,5H2,1H3
InChIKey ORGIHYDPMFXTEZ-UHFFFAOYSA-N
Mol Weight 219.51 g/mol
Molecular Formula C8H8BrCl
Exact Mass 217.949791 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CqZ8ohRedDv
Name 1-(bromomethyl)-3-chloranyl-2-methyl-benzene
CAS Registry Number 90369-76-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8BrCl
InChI InChI=1S/C8H8BrCl/c1-6-7(5-9)3-2-4-8(6)10/h2-4H,5H2,1H3
InChIKey ORGIHYDPMFXTEZ-UHFFFAOYSA-N
Molecular Weight 219.509 g/mol
SMILES c1(c(Cl)cccc1CBr)C
SPLASH splash10-000i-0910000000-1893dc6c053f5247759b
Source of Spectrum J-49-2537-0
Synonyms 1-(bromomethyl)-3-chloro-2-methyl-benzene 2-(bromomethyl)-6-chlorotoluene
Wiley ID 1216998
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