For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Major-isomer

View entire compound with spectra: 3 NMR

Major-isomer
SpectraBase Compound ID Dpl3Pun7cN7
InChI InChI=1S/C33H32NO3P/c35-32(34-23-13-22-30(34)33(36)37-25-26-14-5-1-6-15-26)24-31(27-16-7-2-8-17-27)38(28-18-9-3-10-19-28)29-20-11-4-12-21-29/h1-12,14-21,30-31H,13,22-25H2/t30-,31+/m0/s1
InChIKey UOHWBKLCFNTSTG-IOWSJCHKSA-N
Mol Weight 521.6 g/mol
Molecular Formula C33H32NO3P
Exact Mass 521.211981 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EacyT4cJyPq
Name Major-isomer
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 521.211980889 u
Formula C33H32NO3P
InChI InChI=1S/C33H32NO3P/c35-32(34-23-13-22-30(34)33(36)37-25-26-14-5-1-6-15-26)24-31(27-16-7-2-8-17-27)38(28-18-9-3-10-19-28)29-20-11-4-12-21-29/h1-12,14-21,30-31H,13,22-25H2/t30-,31+/m0/s1
InChIKey UOHWBKLCFNTSTG-IOWSJCHKSA-N
Molecular Weight 521.597 g/mol
SMILES C1(P(C2=CC=CC=C2)[C@@](C2=CC=CC=C2)(CC(=O)N2[C@@](CCC2)(C(=O)OCC2=CC=CC=C2)[H])[H])=CC=CC=C1