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5-Methyl-4-(4-nitrophenyl)diazenyl-1-(4-(pyridin-3-yl)thiazol-2-yl)pyrazolidin-3-one
SpectraBase Compound ID GRF0tRKQyU9
InChI InChI=1S/C18H15N7O3S/c1-11-16(22-21-13-4-6-14(7-5-13)25(27)28)17(26)23-24(11)18-20-15(10-29-18)12-3-2-8-19-9-12/h2-11,16H,1H3,(H,23,26)
InChIKey IMQUDLSDWUFEEW-UHFFFAOYSA-N
Mol Weight 409.42 g/mol
Molecular Formula C18H15N7O3S
Exact Mass 409.095709 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dn3L3HqWXDu
Name 5-Methyl-4-(4-nitrophenyl)diazenyl-1-(4-(pyridin-3-yl)thiazol-2-yl)pyrazolidin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N7O3S
InChI InChI=1S/C18H15N7O3S/c1-11-16(22-21-13-4-6-14(7-5-13)25(27)28)17(26)23-24(11)18-20-15(10-29-18)12-3-2-8-19-9-12/h2-11,16H,1H3,(H,23,26)
InChIKey IMQUDLSDWUFEEW-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8222 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2671
Molecular Weight 409.424 g/mol
SMILES N1N(C(C(C1=O)N=Nc1ccc(cc1)[N+]([O-])=O)C)c1nc(cs1)-c1cnccc1
SPLASH splash10-002f-2934200000-7a71e096855f97eeffd6
Source of Spectrum Y-54-1041-12c
Wiley ID 1878034