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1-N-(Benzylidene)amino-2-N'-(diphenylthioxophosphino)aminocyclohexane

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1-N-(Benzylidene)amino-2-N'-(diphenylthioxophosphino)aminocyclohexane
SpectraBase Compound ID 6QvdMdb8qtB
InChI InChI=1S/C25H27N2PS/c29-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)27-25-19-11-10-18-24(25)26-20-21-12-4-1-5-13-21/h1-9,12-17,20,24-25H,10-11,18-19H2,(H,27,29)/b26-20+
InChIKey BTTARXXBEJEZJE-LHLOQNFPSA-N
Mol Weight 418.54 g/mol
Molecular Formula C25H27N2PS
Exact Mass 418.163257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1HBp981Sqjf
Name 1-N-(Benzylidene)amino-2-N'-(diphenylthioxophosphino)aminocyclohexane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 418.163257049 u
Formula C25H27N2PS
InChI InChI=1S/C25H27N2PS/c29-28(22-14-6-2-7-15-22,23-16-8-3-9-17-23)27-25-19-11-10-18-24(25)26-20-21-12-4-1-5-13-21/h1-9,12-17,20,24-25H,10-11,18-19H2,(H,27,29)/b26-20+
InChIKey BTTARXXBEJEZJE-LHLOQNFPSA-N
Molecular Weight 418.539 g/mol
SMILES C1(NP(=S)(C2=CC=CC=C2)C2=CC=CC=C2)C(\N=C\C=2C=CC=CC2)CCCC1