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Benzenepropanoic acid, 2-bromo-3,5-bis(phenylmethoxy)-
SpectraBase Compound ID 5q9rxs9H7jE
InChI InChI=1S/C23H21BrO4/c24-23-19(11-12-22(25)26)13-20(27-15-17-7-3-1-4-8-17)14-21(23)28-16-18-9-5-2-6-10-18/h1-10,13-14H,11-12,15-16H2,(H,25,26)
InChIKey UDFFESGWANGLOT-UHFFFAOYSA-N
Mol Weight 441.32 g/mol
Molecular Formula C23H21BrO4
Exact Mass 440.062322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8N0z9PmlFc0
Name Benzenepropanoic acid, 2-bromo-3,5-bis(phenylmethoxy)-
CAS Registry Number 105705-38-2
Comments Less than 3 mono-isotopic peaks
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Formula C23H21BrO4
InChI InChI=1S/C23H21BrO4/c24-23-19(11-12-22(25)26)13-20(27-15-17-7-3-1-4-8-17)14-21(23)28-16-18-9-5-2-6-10-18/h1-10,13-14H,11-12,15-16H2,(H,25,26)
InChIKey UDFFESGWANGLOT-UHFFFAOYSA-N
Molecular Weight 441.321 g/mol
SMILES OC(CCc1c(c(cc(c1)OCc1ccccc1)OCc1ccccc1)Br)=O
SPLASH splash10-0006-9000300000-7a1b69baef966258c933
Source of Spectrum B-39-794-10
Synonyms 3-(3,5-Dibenzyloxy-2-bromophenyl)propanoic acid 3-[3,5-bis(benzyloxy)-2-bromophenyl]propanoic acid
Wiley ID 1384624