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1,2,3-Oxadiazolium, 3-[2-(2,4-dimethoxyphenyl)ethyl]-5-hydroxy-, hydroxide, inner salt
SpectraBase Compound ID 7w26amaPH9
InChI InChI=1S/C12H14N2O4/c1-16-10-4-3-9(11(7-10)17-2)5-6-14-8-12(15)18-13-14/h3-4,7-8H,5-6H2,1-2H3
InChIKey VJBWIQKEKAAPIB-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C12H14N2O4
Exact Mass 250.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLPr2kGDZZl
Name 1,2,3-Oxadiazolium, 3-[2-(2,4-dimethoxyphenyl)ethyl]-5-hydroxy-, hydroxide, inner salt
CAS Registry Number 55590-68-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O4
InChI InChI=1S/C12H14N2O4/c1-16-10-4-3-9(11(7-10)17-2)5-6-14-8-12(15)18-13-14/h3-4,7-8H,5-6H2,1-2H3
InChIKey VJBWIQKEKAAPIB-UHFFFAOYSA-N
Molecular Weight 250.254 g/mol
SMILES c1(on[n+](c1)CCc1c(cc(cc1)OC)OC)[O-]
SPLASH splash10-0gb9-2910000000-ffc5213b1daf28a55428
Source of Spectrum O-2-9561-7
Wiley ID 1252958