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1-piperazineacetic acid, 4-(phenylmethyl)-, 2-[(E,2E)-3-phenyl-2-propenylidene]hydrazide
SpectraBase Compound ID 6I9ZIqjKwlm
InChI InChI=1S/C22H26N4O/c27-22(24-23-13-7-12-20-8-3-1-4-9-20)19-26-16-14-25(15-17-26)18-21-10-5-2-6-11-21/h1-13H,14-19H2,(H,24,27)/b12-7+,23-13+
InChIKey UECDLYDMSLAUBB-ZUSHJTOUSA-N
Mol Weight 362.48 g/mol
Molecular Formula C22H26N4O
Exact Mass 362.210661 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DID4oMkekeO
Name 1-Piperazineacetic acid, 4-(phenylmethyl)-, 2-[(E,2E)-3-phenyl-2-propenylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 362.210661472 u
Formula C22H26N4O
InChI InChI=1S/C22H26N4O/c27-22(24-23-13-7-12-20-8-3-1-4-9-20)19-26-16-14-25(15-17-26)18-21-10-5-2-6-11-21/h1-13H,14-19H2,(H,24,27)/b12-7+,23-13+
InChIKey UECDLYDMSLAUBB-ZUSHJTOUSA-N
Molecular Weight 362.477 g/mol
SMILES N(\N=C\C=C\C=1C=CC=CC1)C(CN1CCN(CC1)CC1=CC=CC=C1)=O