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5-(4-Chlorophenyl)-3-[3-(4-methoxyphenyl)sydnon-4-yl]-1H-[1,2,4]triazole
SpectraBase Compound ID Hc8wI0tFHwZ
InChI InChI=1S/C17H11ClN5O3/c1-25-13-8-6-12(7-9-13)23-14(17(24)26-22-23)16-19-15(20-21-16)10-2-4-11(18)5-3-10/h2-9H,1H3/q-1/p+1
InChIKey NJCSZULQBBKDSK-UHFFFAOYSA-O
Mol Weight 369.77 g/mol
Molecular Formula C17H12ClN5O3
Exact Mass 369.062867 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72UPnuaPtaB
Name 5-(4-Chlorophenyl)-3-[3-(4-methoxyphenyl)sydnon-4-yl]-1H-[1,2,4]triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClN5O3
InChI InChI=1S/C17H11ClN5O3/c1-25-13-8-6-12(7-9-13)23-14(17(24)26-22-23)16-19-15(20-21-16)10-2-4-11(18)5-3-10/h2-9H,1H3/q-1/p+1
InChIKey NJCSZULQBBKDSK-UHFFFAOYSA-O
Molecular Weight 369.768 g/mol
SMILES [nH]1c(nc(n1)-c1[n+](noc1[O-])-c1ccc(cc1)OC)-c1ccc(cc1)Cl
SPLASH splash10-03di-0009000000-0ca9a78b96f4b30536f9
Source of Spectrum C5-2004-2882-4
Wiley ID 1617624