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1-(2,4-Dinitrophenyl)-3-methyl-N-(2-phenylethyl)-1H-pyrazol-5-amine

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1-(2,4-Dinitrophenyl)-3-methyl-N-(2-phenylethyl)-1H-pyrazol-5-amine
SpectraBase Compound ID 8stZEhG0rqM
InChI InChI=1S/C18H17N5O4/c1-13-11-18(19-10-9-14-5-3-2-4-6-14)21(20-13)16-8-7-15(22(24)25)12-17(16)23(26)27/h2-8,11-12,19H,9-10H2,1H3
InChIKey DAFWTGSXZLKENP-UHFFFAOYSA-N
Mol Weight 367.37 g/mol
Molecular Formula C18H17N5O4
Exact Mass 367.128054 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5uVAx19kKu2
Name 1-(2,4-Dinitrophenyl)-3-methyl-N-(2-phenylethyl)-1H-pyrazol-5-amine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 367.128054043 u
Formula C18H17N5O4
InChI InChI=1S/C18H17N5O4/c1-13-11-18(19-10-9-14-5-3-2-4-6-14)21(20-13)16-8-7-15(22(24)25)12-17(16)23(26)27/h2-8,11-12,19H,9-10H2,1H3
InChIKey DAFWTGSXZLKENP-UHFFFAOYSA-N
Molecular Weight 367.365 g/mol
SMILES C1=CC=C(CCNC=2N(C=3C(N(=O)=O)=CC(N(=O)=O)=CC3)N=C(C)C2)C=C1