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1-piperazinamine, N-[(E)-(3-methyl-2-thienyl)methylidene]-4-(1-naphthalenylmethyl)-
SpectraBase Compound ID J3QERUzKni0
InChI InChI=1S/C21H23N3S/c1-17-9-14-25-21(17)15-22-24-12-10-23(11-13-24)16-19-7-4-6-18-5-2-3-8-20(18)19/h2-9,14-15H,10-13,16H2,1H3/b22-15+
InChIKey CLKQTSVGWGVKLN-PXLXIMEGSA-N
Mol Weight 349.5 g/mol
Molecular Formula C21H23N3S
Exact Mass 349.161269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6r2f7GKExPK
Name 1-Piperazinamine, N-[(E)-(3-methyl-2-thienyl)methylidene]-4-(1-naphthalenylmethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.161268927 u
Formula C21H23N3S
InChI InChI=1S/C21H23N3S/c1-17-9-14-25-21(17)15-22-24-12-10-23(11-13-24)16-19-7-4-6-18-5-2-3-8-20(18)19/h2-9,14-15H,10-13,16H2,1H3/b22-15+
InChIKey CLKQTSVGWGVKLN-PXLXIMEGSA-N
Molecular Weight 349.496 g/mol
SMILES C1(\C=N\N2CCN(CC2)CC=2C3=C(C=CC=C3)C=CC2)=C(C=CS1)C