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3-tert-Butyl-4-phenyl-1,2,3-oxadiazol-3-ium-5-olate
SpectraBase Compound ID 2gmnTN4coDt
InChI InChI=1S/C12H14N2O2/c1-12(2,3)14-10(11(15)16-13-14)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey JLJFSGUJRNLEGY-UHFFFAOYSA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQle6dUIX4R
Name 3-tert-Butyl-4-phenyl-1,2,3-oxadiazol-3-ium-5-olate
CAS Registry Number 40628-17-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-12(2,3)14-10(11(15)16-13-14)9-7-5-4-6-8-9/h4-8H,1-3H3
InChIKey JLJFSGUJRNLEGY-UHFFFAOYSA-N
Molecular Weight 218.256 g/mol
SMILES c1(on[n+](c1-c1ccccc1)C(C)(C)C)[O-]
SPLASH splash10-0a4i-9400000000-3c7a6133e04aa0c69bba
Source of Spectrum H-61-1499-0
Synonyms 3-tert-Butyl-4-phenyl-5-oxadiazol-3-iumolate 3-tert-Butyl-4-phenyl-oxadiazol-3-ium-5-olate
Wiley ID 1217500