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(R,R)-(4-Meph)2P-N-2-naphthoyl-diphenyl-imidazoline

View entire compound with spectra: 2 NMR

(R,R)-(4-Meph)2P-N-2-naphthoyl-diphenyl-imidazoline
SpectraBase Compound ID 7Zb3N3a7mZq
InChI InChI=1S/C46H37N2OP/c1-32-21-27-39(28-22-32)50(40-29-23-33(2)24-30-40)42-20-12-11-19-41(42)45-47-43(35-14-5-3-6-15-35)44(36-16-7-4-8-17-36)48(45)46(49)38-26-25-34-13-9-10-18-37(34)31-38/h3-31,43-44H,1-2H3/t43-,44-/m1/s1
InChIKey MRCQYMFICNXHAD-NDOUMJCMSA-N
Mol Weight 664.8 g/mol
Molecular Formula C46H37N2OP
Exact Mass 664.264351 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HuGMtaAmOh
Name (R,R)-(4-Meph)2P-N-2-naphthoyl-diphenyl-imidazoline
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 664.264350816 u
Formula C46H37N2OP
InChI InChI=1S/C46H37N2OP/c1-32-21-27-39(28-22-32)50(40-29-23-33(2)24-30-40)42-20-12-11-19-41(42)45-47-43(35-14-5-3-6-15-35)44(36-16-7-4-8-17-36)48(45)46(49)38-26-25-34-13-9-10-18-37(34)31-38/h3-31,43-44H,1-2H3/t43-,44-/m1/s1
InChIKey MRCQYMFICNXHAD-NDOUMJCMSA-N
Molecular Weight 664.789 g/mol
SMILES C1(P(C2=CC=C(C=C2)C)C2=C(C=CC=C2)C=2N(C(=O)C3=CC=C4C=CC=CC4=C3)[C@@]([C@](N2)(C2=CC=CC=C2)[H])(C2=CC=CC=C2)[H])=CC=C(C=C1)C