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5-Bromo-2-(hexyloxy)benzoic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

5-Bromo-2-(hexyloxy)benzoic acid
SpectraBase Compound ID KRc5gtHiF55
InChI InChI=1S/C13H17BrO3/c1-2-3-4-5-8-17-12-7-6-10(14)9-11(12)13(15)16/h6-7,9H,2-5,8H2,1H3,(H,15,16)
InChIKey QHRNNKWZVDZLRA-UHFFFAOYSA-N
Mol Weight 301.18 g/mol
Molecular Formula C13H17BrO3
Exact Mass 300.036107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jB5ft59ay
Name 5-Bromo-2-(hexyloxy)benzoic acid
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BrO3
InChI InChI=1S/C13H17BrO3/c1-2-3-4-5-8-17-12-7-6-10(14)9-11(12)13(15)16/h6-7,9H,2-5,8H2,1H3,(H,15,16)
InChIKey QHRNNKWZVDZLRA-UHFFFAOYSA-N
Molecular Weight 301.180 g/mol
SMILES OC(c1c(ccc(c1)Br)OCCCCCC)=O
SPLASH splash10-0fr5-9670000000-e7cbf6c135f9bf3681f7
Source of Spectrum IY-1-4271-1
Synonyms Benzoic acid, 5-bromo-2-(hexyloxy)- 5-Bromo-2-hexoxybenzoic acid 5-Bromanyl-2-hexoxy-benzoic acid
Wiley ID 1650704