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3-(p-Ethyloxyphenyl)-4-[5'-phenyl-4'-cyanoisoxazol-3'-yl]sydnone

View entire compound with spectra: 1 MS (GC)

3-(p-Ethyloxyphenyl)-4-[5'-phenyl-4'-cyanoisoxazol-3'-yl]sydnone
SpectraBase Compound ID GnRAfUPLkBx
InChI InChI=1S/C20H14N4O4/c1-2-26-15-10-8-14(9-11-15)24-18(20(25)28-23-24)17-16(12-21)19(27-22-17)13-6-4-3-5-7-13/h3-11H,2H2,1H3
InChIKey PRMCWMYDBHWOMF-UHFFFAOYSA-N
Mol Weight 374.36 g/mol
Molecular Formula C20H14N4O4
Exact Mass 374.101505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EjT3Yh5UIoM
Name 3-(p-Ethyloxyphenyl)-4-[5'-phenyl-4'-cyanoisoxazol-3'-yl]sydnone
Alternate Name(s) 4-(4-cyano-5-phenyl-3-isoxazolyl)-3-(4-ethoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14N4O4
InChI InChI=1S/C20H14N4O4/c1-2-26-15-10-8-14(9-11-15)24-18(20(25)28-23-24)17-16(12-21)19(27-22-17)13-6-4-3-5-7-13/h3-11H,2H2,1H3
InChIKey PRMCWMYDBHWOMF-UHFFFAOYSA-N
Molecular Weight 374.356 g/mol
SMILES c1([n+](noc1[O-])-c1ccc(cc1)OCC)-c1c(c(-c2ccccc2)on1)C#N
SPLASH splash10-014i-0009000000-f33ca981772bb898b5f3
Source of Spectrum QA-39-167-4
Wiley ID 861420