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3-(4-butoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate

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3-(4-butoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate
SpectraBase Compound ID PGhEFZwDFZ
InChI InChI=1S/C12H14N2O3/c1-2-3-8-16-11-6-4-10(5-7-11)14-9-12(15)17-13-14/h4-7,9H,2-3,8H2,1H3
InChIKey KLAORJKZHFJURJ-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C12H14N2O3
Exact Mass 234.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CO6GN0pfCMD
Name 3-(4-butoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O3
InChI InChI=1S/C12H14N2O3/c1-2-3-8-16-11-6-4-10(5-7-11)14-9-12(15)17-13-14/h4-7,9H,2-3,8H2,1H3
InChIKey KLAORJKZHFJURJ-UHFFFAOYSA-N
Molecular Weight 234.255 g/mol
SMILES c1(on[n+](c1)-c1ccc(cc1)OCCCC)[O-]
SPLASH splash10-03fr-0790000000-69b53f6e2147ba74fdff
Source of Spectrum QA-45-388-0
Synonyms 3-(4-butoxyphenyl)-5-oxadiazol-3-iumolate 3-(4-butoxyphenyl)oxadiazol-3-ium-5-olate
Wiley ID 862970