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1,2,3-Oxadiazolium, 3-(2,2-dimethylbutyl)-5-hydroxy-, hydroxide, inner salt
SpectraBase Compound ID 5KjQrkNL6gN
InChI InChI=1S/C8H14N2O2/c1-4-8(2,3)6-10-5-7(11)12-9-10/h5H,4,6H2,1-3H3
InChIKey QSWHOLZNFCOIEA-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C8H14N2O2
Exact Mass 170.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1b96Qr0X1k
Name 1,2,3-Oxadiazolium, 3-(2,2-dimethylbutyl)-5-hydroxy-, hydroxide, inner salt
CAS Registry Number 54460-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14N2O2
InChI InChI=1S/C8H14N2O2/c1-4-8(2,3)6-10-5-7(11)12-9-10/h5H,4,6H2,1-3H3
InChIKey QSWHOLZNFCOIEA-UHFFFAOYSA-N
Molecular Weight 170.212 g/mol
SMILES CCC(C)(C)C[n+]1cc([O-])on1
SPLASH splash10-0006-9000000000-b1303fdcd1f7f3fd1216
Source of Spectrum O-2-9548-0
Synonyms 3-(2,2-Dimethylbutyl)-1,2,3-oxadiazol-3-ium-5-olate 3-(2,2-dimethylbutyl)-5-oxadiazol-3-iumolate 3-(2,2-dimethylbutyl)oxadiazol-3-ium-5-olate
Wiley ID 1166378