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Benzoic acid, 2,3,4,5-tetrabromo-6-methyl-
SpectraBase Compound ID LNSRPqcfWT2
InChI InChI=1S/C8H4Br4O2/c1-2-3(8(13)14)5(10)7(12)6(11)4(2)9/h1H3,(H,13,14)
InChIKey LIIDUPNLTYDTEI-UHFFFAOYSA-N
Mol Weight 451.73 g/mol
Molecular Formula C8H4Br4O2
Exact Mass 447.694481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6co6zKmcTDA
Name Benzoic acid, 2,3,4,5-tetrabromo-6-methyl-
Alternate Name(s) 2,3,4,5-Tetrabromo-6-methylbenzoic acid
CAS Registry Number 63165-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4Br4O2
InChI InChI=1S/C8H4Br4O2/c1-2-3(8(13)14)5(10)7(12)6(11)4(2)9/h1H3,(H,13,14)
InChIKey LIIDUPNLTYDTEI-UHFFFAOYSA-N
Molecular Weight 451.734 g/mol
SMILES OC(c1c(c(Br)c(c(c1C)Br)Br)Br)=O
SPLASH splash10-0udi-0010900000-4a3421b818ff898d7a93
Source of Spectrum B-30-300-0
Wiley ID 1387007