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4-{2-[(4-Chlorophenyl)sulfanyl]ethoxy}benzaldehyde [4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl]hydrazone
SpectraBase Compound ID HN3OAcXOcmW
InChI InChI=1S/C26H30ClN7OS/c27-21-7-11-23(12-8-21)36-18-17-35-22-9-5-20(6-10-22)19-28-32-24-29-25(33-13-1-2-14-33)31-26(30-24)34-15-3-4-16-34/h5-12,19H,1-4,13-18H2,(H,29,30,31,32)/b28-19+
InChIKey YOMCPFXDUOFRAU-TURZUDJPSA-N
Mol Weight 524.09 g/mol
Molecular Formula C26H30ClN7OS
Exact Mass 523.192107 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IUgOCFrCHTD
Name 4-{2-[(4-Chlorophenyl)sulfanyl]ethoxy}benzaldehyde [4,6-di(1-pyrrolidinyl)-1,3,5-triazin-2-yl]hydrazone
Comments Computed using HOSE algorithm
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Exact Mass 523.192107487 u
Formula C26H30ClN7OS
InChI InChI=1S/C26H30ClN7OS/c27-21-7-11-23(12-8-21)36-18-17-35-22-9-5-20(6-10-22)19-28-32-24-29-25(33-13-1-2-14-33)31-26(30-24)34-15-3-4-16-34/h5-12,19H,1-4,13-18H2,(H,29,30,31,32)/b28-19+
InChIKey YOMCPFXDUOFRAU-TURZUDJPSA-N
Molecular Weight 524.087 g/mol
SMILES N(\N=C\C=1C=CC(=CC1)OCCSC1=CC=C(C=C1)Cl)C=1N=C(N=C(N1)N1CCCC1)N1CCCC1