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2-(4-imidazol-1-ylbutoxy)benzoic acid
SpectraBase Compound ID 5mxMFulIhbU
InChI InChI=1S/C14H16N2O3/c17-14(18)12-5-1-2-6-13(12)19-10-4-3-8-16-9-7-15-11-16/h1-2,5-7,9,11H,3-4,8,10H2,(H,17,18)
InChIKey MJOGBMCKBIKSGT-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C14H16N2O3
Exact Mass 260.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6RijHSv8JE8
Name 2-(4-imidazol-1-ylbutoxy)benzoic acid
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16N2O3
InChI InChI=1S/C14H16N2O3/c17-14(18)12-5-1-2-6-13(12)19-10-4-3-8-16-9-7-15-11-16/h1-2,5-7,9,11H,3-4,8,10H2,(H,17,18)
InChIKey MJOGBMCKBIKSGT-UHFFFAOYSA-N
Instrument Name VG ZAB 2F
Ionization Type EI
Literature Reference DOI 10.1002/rcm.1290080814
Molecular Weight 260.293 g/mol
SMILES OC(c1c(OCCCC[n]2cncc2)cccc1)=O
SPLASH splash10-00dl-9500000000-7465b9f63813abed8eba
Source of Spectrum RCM-8-640-7
Wiley ID 1835700