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3-(4'-Methoxyphenyl)-4-(4,5,6,7-tetrahydrobenzo[d]isoxazol-3-yl)sydnone
SpectraBase Compound ID CZcCzyVik1Z
InChI InChI=1S/C16H15N3O4/c1-21-11-8-6-10(7-9-11)19-15(16(20)23-18-19)14-12-4-2-3-5-13(12)22-17-14/h6-9H,2-5H2,1H3
InChIKey NCDRTJGWTHGGOS-UHFFFAOYSA-N
Mol Weight 313.31 g/mol
Molecular Formula C16H15N3O4
Exact Mass 313.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IZINJMgvaG0
Name 3-(4'-Methoxyphenyl)-4-(4,5,6,7-tetrahydrobenzo[d]isoxazol-3-yl)sydnone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O4
InChI InChI=1S/C16H15N3O4/c1-21-11-8-6-10(7-9-11)19-15(16(20)23-18-19)14-12-4-2-3-5-13(12)22-17-14/h6-9H,2-5H2,1H3
InChIKey NCDRTJGWTHGGOS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100169
Molecular Weight 313.313 g/mol
SMILES c1([n+](noc1[O-])-c1ccc(cc1)OC)-c1noc2c1CCCC2
SPLASH splash10-0a4i-3290000000-d3a132fad5987dbccede
Source of Spectrum QA-48-1150-8c
Synonyms 3-(4-Methoxyphenyl)-4-(4,5,6,7-tetrahydrobenzo[d]isoxazol-3-yl)-1,2,3-oxadiazol-3-ium-5-olate
Wiley ID 1795517