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3-[3-(4-Methylphenyl)sydnon-4-yl]-5-(3-phenylsydnon-4-yl)-1H-[1,2,4]triazole
SpectraBase Compound ID 3OiWOKS7e3y
InChI InChI=1S/C19H13N7O4/c1-11-7-9-13(10-8-11)26-15(19(28)30-24-26)17-20-16(21-22-17)14-18(27)29-23-25(14)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,23,24,27,28)
InChIKey NUCOQRFNPVUEAR-UHFFFAOYSA-N
Mol Weight 403.36 g/mol
Molecular Formula C19H13N7O4
Exact Mass 403.102902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxKjnhAVM9c
Name 3-[3-(4-Methylphenyl)sydnon-4-yl]-5-(3-phenylsydnon-4-yl)-1H-[1,2,4]triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H13N7O4
InChI InChI=1S/C19H13N7O4/c1-11-7-9-13(10-8-11)26-15(19(28)30-24-26)17-20-16(21-22-17)14-18(27)29-23-25(14)12-5-3-2-4-6-12/h2-10H,1H3,(H-,20,23,24,27,28)
InChIKey NUCOQRFNPVUEAR-UHFFFAOYSA-N
Molecular Weight 403.358 g/mol
SMILES [nH]1c(nc(n1)-c1[n+](noc1[O-])-c1ccc(cc1)C)-c1[n+](noc1[O-])-c1ccccc1
SPLASH splash10-002v-9055100000-667efadf9c84f6439343
Source of Spectrum C5-2004-2884-6
Wiley ID 1617612