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1-(4-Nitrophenyl)-3-(2-thienyl)-5-(3-methylaminopropyl)pyrazole perchlorate
SpectraBase Compound ID GEWs3a4jrTq
InChI InChI=1S/C17H18N4O2S.ClHO4/c1-18-10-2-4-15-12-16(17-5-3-11-24-17)19-20(15)13-6-8-14(9-7-13)21(22)23;2-1(3,4)5/h3,5-9,11-12,18H,2,4,10H2,1H3;(H,2,3,4,5)
InChIKey UDUNJTZLZHRWFR-UHFFFAOYSA-N
Mol Weight 442.87 g/mol
Molecular Formula C17H19ClN4O6S
Exact Mass 442.071383 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6QRr9xdbyQ9
Name 1-(4-Nitrophenyl)-3-(2-thienyl)-5-(3-methylaminopropyl)pyrazole perchlorate
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Formula C17H19ClN4O6S
InChI InChI=1S/C17H18N4O2S.ClHO4/c1-18-10-2-4-15-12-16(17-5-3-11-24-17)19-20(15)13-6-8-14(9-7-13)21(22)23;2-1(3,4)5/h3,5-9,11-12,18H,2,4,10H2,1H3;(H,2,3,4,5)
InChIKey UDUNJTZLZHRWFR-UHFFFAOYSA-N
Molecular Weight 442.874 g/mol
SMILES O[Cl](=O)(=O)=O.N(CCCc1[n](nc(c1)-c1cccs1)-c1ccc(cc1)N(=O)=O)C
SPLASH splash10-0006-9040000000-3b1d4e10b36edb16e333
Source of Spectrum SO-0-1155-10
Synonyms perchloric acid compound with N-methyl-3-[1-(4-nitrophenyl)-3-(2-thienyl)-1H-pyrazol-5-yl]-1-propanamine (1:1)
Wiley ID 1542740